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    Also known as: 78213-16-8, Diclofenac (diethylamine), Diclofenac diethylammonium salt, 6tgq35z71k, 2-[2-(2,6-dichloroanilino)phenyl]acetic acid;n-ethylethanamine, Voltarol
    Molecular Formula
    C18H22Cl2N2O2
    Molecular Weight
    369.3  g/mol
    InChI Key
    ZQVZPANTCLRASL-UHFFFAOYSA-N
    FDA UNII
    6TGQ35Z71K
    Diclofenac Diethylamine
    1 2D Structure

    Diclofenac Diethylamine

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-[2-(2,6-dichloroanilino)phenyl]acetic acid;N-ethylethanamine
    2.1.2 InChI
    InChI=1S/C14H11Cl2NO2.C4H11N/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19;1-3-5-4-2/h1-7,17H,8H2,(H,18,19);5H,3-4H2,1-2H3
    2.1.3 InChI Key
    ZQVZPANTCLRASL-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCNCC.C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)Cl
    2.2 Other Identifiers
    2.2.1 UNII
    6TGQ35Z71K
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 78213-16-8

    2. Diclofenac (diethylamine)

    3. Diclofenac Diethylammonium Salt

    4. 6tgq35z71k

    5. 2-[2-(2,6-dichloroanilino)phenyl]acetic Acid;n-ethylethanamine

    6. Voltarol

    7. Mfcd01862249

    8. Benzeneacetic Acid, 2-((2,6-dichlorophenyl)amino)-, Compd. With N-ethylethanamine (1:1)

    9. Diclofenac Diethylammonium

    10. Diclofenac Diethylamine Salt

    11. Unii-6tgq35z71k

    12. Voltaren Emulgel (tn)

    13. N-ethylethanaminium{2-[(2,6-dichlorophenyl)amino]phenyl}acetate

    14. Diethylammonium Diclofenac

    15. 2-((2,6-dichlorophenyl)amino)benzeneacetic Acid, Compd. With N-ethylethanamine

    16. Schembl1116300

    17. Dtxsid40999449

    18. 4-bromo-4-methoxybiphenyl

    19. Hms3651l18

    20. Hms3885e07

    21. Bcp24521

    22. Hy-15036a

    23. S3063

    24. Akos015907253

    25. Ccg-268279

    26. Diclofenac Diethylamine [mart.]

    27. Ks-5039

    28. Diclofenac Diethylamine [who-dd]

    29. Sy110689

    30. Db-056293

    31. Diclofenac Diethylammonium Salt [mi]

    32. Ft-0603077

    33. Sw219367-1

    34. D07817

    35. H10150

    36. 213d168

    37. A923342

    38. Diclofenac Diethylamine (diethylammonium Diclofenac)

    39. Q27265501

    40. Diethylamine 2-(2-(2,6-dichlorophenylamino)phenyl)acetate

    41. [2-(2,6-dichloroanilino)phenyl]acetic Acid--n-ethylethanamine (1/1)

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 369.3 g/mol
    Molecular Formula C18H22Cl2N2O2
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count6
    Exact Mass368.1058333 g/mol
    Monoisotopic Mass368.1058333 g/mol
    Topological Polar Surface Area61.4 Ų
    Heavy Atom Count24
    Formal Charge0
    Complexity315
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2

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