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DSSTox_CID_3252
Also known as: 76-90-4, Cantil, Cantilaque, Colibantil, Gastropidil, Cantilon
Molecular Formula
C21H26BrNO3
Molecular Weight
420.3  g/mol
InChI Key
JRRNZNSGDSFFIR-UHFFFAOYSA-M
FDA UNII
APX8D32IX1

1 2D Structure

DSSTox_CID_3252

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(1,1-dimethylpiperidin-1-ium-3-yl) 2-hydroxy-2,2-diphenylacetate;bromide
2.1.2 InChI
InChI=1S/C21H26NO3.BrH/c1-22(2)15-9-14-19(16-22)25-20(23)21(24,17-10-5-3-6-11-17)18-12-7-4-8-13-18;/h3-8,10-13,19,24H,9,14-16H2,1-2H3;1H/q+1;/p-1
2.1.3 InChI Key
JRRNZNSGDSFFIR-UHFFFAOYSA-M
2.1.4 Canonical SMILES
C[N+]1(CCCC(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C.[Br-]
2.2 Other Identifiers
2.2.1 UNII
APX8D32IX1
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Cantil

2. Mepenzolate

3. Mepenzolate Bromide, (+-)-isomer

4. Mepenzolate Iodide

5. Mepenzolic Acid

6. Mepenzolic Acid, Bromine Salt

7. Mepenzolic Acid, Bromine Salt, 1-(methyl-(14)c)-labeled

8. N-methyl-3-piperidylbenzilate Methyl Bromide

2.3.2 Depositor-Supplied Synonyms

1. 76-90-4

2. Cantil

3. Cantilaque

4. Colibantil

5. Gastropidil

6. Cantilon

7. Colopiril

8. Delevil

9. Eftoron

10. Tralanta

11. Trancolon

12. Colum

13. Mepenzolate (bromide)

14. Jb 340

15. 3-(2-hydroxy-2,2-diphenylacetoxy)-1,1-dimethylpiperidin-1-ium Bromide

16. 3-hydroxy-1,1-dimethylpiperidinium Bromide Benzilate

17. N-methyl-3-piperidyl Benzilate Methobromide

18. N-methyl-3-piperidyl Benzilate Methyl Bromide

19. Cantril

20. N-methyl-3-piperidyldiphenylglycolate Methobromide

21. Benzilic Acid, 1-methyl-3-piperidyl Ester Methobromide

22. Nsc-4358

23. An-6437

24. Apx8d32ix1

25. Hy-17585

26. Ft-0671006

27. Trokonil

28. Piperidinium, 3-((hydroxydiphenylacetyl)oxy)-1,1-dimethyl-, Bromide

29. Piperidinium, 3-[(hydroxydiphenylacetyl)oxy]-1,1-dimethyl-, Bromide

30. (1,1-dimethylpiperidin-1-ium-3-yl) 2-hydroxy-2,2-diphenylacetate;bromide

31. Dsstox_cid_3252

32. (1,1-dimethylpiperidin-1-ium-3-yl) 2-hydroxy-2,2-diphenylacetate,bromide

33. Dsstox_rid_76941

34. Dsstox_gsid_23252

35. Mepenzolati Bromidum

36. Bromure De Mepenzolate

37. Bromuro De Mepenzolato

38. 1-methyl-3-piperidyl Benzilate Methyl Bromide

39. Mepenzolati Bromidum [inn-latin]

40. Bromure De Mepenzolate [inn-french]

41. Mepenzolone Bromide

42. Bromuro De Mepenzolato [inn-spanish]

43. Smr000058832

44. Cantil (tn)

45. 1-methyl-3-piperidyl Benzilate Methylbromide

46. Mepenzolate Methylbromide

47. Sr-01000765452

48. Nsc 4358

49. Einecs 200-992-7

50. Unii-apx8d32ix1

51. 3-((hydroxydiphenylacetyl)oxy)-1,1-dimethylpiperidinium Bromide

52. Benzilic Acid, Ester With 3-hydroxy-1,1-dimethylpiperidinium Bromide

53. Prestwick_100

54. Piperidinium, 3-hydroxy-1,1-dimethyl-, Bromide, Benzilate

55. Mepenzolate Bromide [usp:inn:ban:jan]

56. Cas-76-90-4

57. Ncgc00016314-01

58. Chembl1724

59. Schembl99030

60. Mls001076678

61. Mls002222165

62. Spectrum1500383

63. Chebi:6753

64. Dtxsid4023252

65. Mepenzolate Bromide [mi]

66. Hms501p18

67. Mepenzolate Bromide [inn]

68. Mepenzolate Bromide [jan]

69. Nsc4358

70. Mepenzolate Bromide (jp17/inn)

71. Hms1570c07

72. Hms1920l05

73. Hms2091b18

74. Hms2097c07

75. Hms2231p11

76. Hms3259o19

77. Hms3369a20

78. Hms3714c07

79. Pharmakon1600-01500383

80. Piperidinium,1-dimethyl-, Bromide

81. Mepenzolate Bromide [vandf]

82. 3-[(hydroxy-diphenylacetyl)oxy]-1,1-dimethylpiperidinium Bromide

83. 3-{[hydroxy(diphenyl)acetyl]oxy}-1,1-dimethylpiperidinium Bromide

84. Mepenzolate Bromide [mart.]

85. Tox21_110367

86. Ccg-40131

87. Mepenzolate Bromide [who-dd]

88. Nsc757099

89. Akos015962135

90. Tox21_110367_1

91. Cs-3578

92. Nc00518

93. Nsc-757099

94. Mepenzolate Bromide [orange Book]

95. Ncgc00094716-01

96. Ncgc00094716-02

97. Ncgc00178896-05

98. Wln: T6ktj A1 A1 Covxqr&r &e

99. Ac-15989

100. As-75556

101. Benzilic Acid,1-dimethylpiperidinium Bromide

102. Piperidinium,1-dimethyl-, Bromide, Benzilate

103. D00720

104. D94756

105. A865394

106. Sr-01000765452-2

107. Sr-01000765452-3

108. Q27274055

109. 3-(2-hydroxy-2,2-diphenylacetoxy)-1,1-dimethylpiperidinium Bromide

110. 3-(2-hydroxy-2,2-diphenylacetoxy)-1,1-dimethylpiperidin-1-iumbromide

2.4 Create Date
2005-06-24
3 Chemical and Physical Properties
Molecular Weight 420.3 g/mol
Molecular Formula C21H26BrNO3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass419.10961 g/mol
Monoisotopic Mass419.10961 g/mol
Topological Polar Surface Area46.5 Ų
Heavy Atom Count26
Formal Charge0
Complexity432
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
4 Drug and Medication Information
4.1 Drug Information
1 of 2  
Drug NameCantil
PubMed HealthMepenzolate (By mouth)
Drug ClassesGastrointestinal Agent
Drug LabelCANTIL tablets for oral administration contain 25 mg mepenzolate bromide USP. The anticholinergic agent mepenzolate bromide USP chemically is 3-[(hydroxydiphenylacetyl)oxy]-1,1-dimethylpiperidinium bromide and has the following structure:Mepenzolate...
Active IngredientMepenzolate bromide
Dosage FormTablet
RouteOral
Strength25mg
Market StatusPrescription
CompanySanofi Aventis Us

2 of 2  
Drug NameCantil
PubMed HealthMepenzolate (By mouth)
Drug ClassesGastrointestinal Agent
Drug LabelCANTIL tablets for oral administration contain 25 mg mepenzolate bromide USP. The anticholinergic agent mepenzolate bromide USP chemically is 3-[(hydroxydiphenylacetyl)oxy]-1,1-dimethylpiperidinium bromide and has the following structure:Mepenzolate...
Active IngredientMepenzolate bromide
Dosage FormTablet
RouteOral
Strength25mg
Market StatusPrescription
CompanySanofi Aventis Us

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