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Overview

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10,11-Epoxycarbamazepine
PharmaCompass
  • Chemistry
10,11-Epoxycarbamazepine
Also known as: Carbamazepine epoxide, 36507-30-9, Carbamazepine 10,11-epoxide, 10,11-epoxycarbamazepine, Carbamazepine 10,11-oxide, 1a,10b-dihydro-6h-dibenzo[b,f]oxireno[d]azepine-6-carboxamide
Molecular Formula
C15H12N2O2
Molecular Weight
252.273  g/mol
InChI Key
ZRWWEEVEIOGMMT-UHFFFAOYSA-N

1 2D Structure

10,11-Epoxycarbamazepine

2 Identification
2.1 Computed Descriptors
2.1.1 InChI
InChI=1S/C15H12N2O2/c16-15(18)17-11-7-3-1-5-9(11)13-14(19-13)10-6-2-4-8-12(10)17/h1-8,13-14H,(H2,16,18)
2.1.2 InChI Key
ZRWWEEVEIOGMMT-UHFFFAOYSA-N
2.1.3 Canonical SMILES
C1=CC=C2C(=C1)C3C(O3)C4=CC=CC=C4N2C(=O)N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. Carbamazepine Epoxide

2. 36507-30-9

3. Carbamazepine 10,11-epoxide

4. 10,11-epoxycarbamazepine

5. Carbamazepine 10,11-oxide

6. 1a,10b-dihydro-6h-dibenzo[b,f]oxireno[d]azepine-6-carboxamide

7. Gp 49-023

8. Carbamazepine-10,11-trans-dihydrodiol

9. Brn 1219988

10. Chebi:3388

11. 1ah-dibenzo[b,f]oxireno[2,3-d]azepine-6(10bh)-carboxamide

12. 6h-dibenz[b,f]oxireno[d]azepine-6-carboxamide, 1a,10b-dihydro-

13. 10,11-dihydro-10,11-epoxycarbamazepine

14. 1a,10b-dihydro-6h-dibenz(b,f)oxiren(d)azepine-6-carboxamide

15. 6h-dibenz(b,f)oxiren(d)azepine-6-carboxamide, 1a,10b-dihydro-

16. Carbamazepine 10,11-epoxide, Analytical Standard

17. 1a,10b-dihydro-6h-dibenz(b,f)oxireno(d)azepine-6-carboxamide

18. 1a,10b-dihydro-6h-dibenz[b,f]oxireno[d]azepine-6-carboxamide

19. 1a,10b-dihydro-6h-dibenzo(b,f)oxireno[d]azepine-6-carboxamide

20. Ac1l1dxw

21. Ac1q5kgn

22. Chembl1258

23. Schembl156675

24. Ctk4h6556

25. Ks-00000hfc

26. Molport-003-845-583

27. Zrwweeveiogmmt-uhfffaoysa-n

28. Bdbm50446047

29. Mfcd00467137

30. Akos027327549

31. Api0000438

32. Ak326023

33. Bc251795

34. Ds-11818

35. Ls-61643

36. Sc-65307

37. Ab0071648

38. Ft-0639322

39. C07496

40. 507d309

41. Carbamazepine 10,11-epoxide 1.0 Mg/ml In Acetonitrile

42. 1a,10b-dihdyro-6h-dibenzo[b,f]oxireno[d]azepine-6-carboxamide

43. 1a,10b-dihydro-6h-dibenzo[b,f]oxireno[d]azepine-6-

44. 6h-dibenz[b,f]oxireno[d]azepine-6-carboxamide,1a,10b-dihydro-

45. 1a,10b-dihydro-6h-dibenzo[b,f]oxireno[2,3-d]azepine-6-carboxamide

46. 1a,10b-dihydro-6h-dibenzo[b,f]oxireno[2,3-d]azepine-6-carboxamide #

47. 3-oxa-11-azatetracyclo[10.4.0.0(2),?.0?,(1)?]hexadeca-1(12),5(10),6,8,13,15-hexaene-11-carboxamide

48. 3-oxa-11-azatetracyclo[10.4.0.0(2),?.0?,(1)?]hexadeca-1(16),5,7,9,12,14-hexaene-11-carboxamide

49. Carbamazepine-10,11-epoxide Solution, 1.0 Mg/ml In Methanol, Ampule Of 1 Ml, Certified Reference Material

2.3 Create Date
2005-03-25
3 Chemical and Physical Properties
Molecular Weight 252.273 g/mol
Molecular Formula C15H12N2O2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass252.09 g/mol
Monoisotopic Mass252.09 g/mol
Topological Polar Surface Area58.9 A^2
Heavy Atom Count19
Formal Charge0
Complexity358
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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