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    Isoconazole Nitrate

    ACTIVE PHARMA INGREDIENTS

    FINISHED DOSAGE FORMULATIONS

    DIGITAL CONTENT

    GLOBAL SALES INFORMATION

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    REF. STANDARDS & IMPURITIES

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    2D Structure
    Also known as: 24168-96-5, Travogyn, Fazol, Isoconazole (nitrate), Isoconazole nitrate [jan], Adestan g 100
    Molecular Formula
    C18H15Cl4N3O4
    Molecular Weight
    479.1  g/mol
    InChI Key
    NNGQLSIGRSTLLU-UHFFFAOYSA-N
    FDA UNII
    5AS8P3N30X
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-[2-(2,4-dichlorophenyl)-2-[(2,6-dichlorophenyl)methoxy]ethyl]imidazole;nitric acid
    2.1.2 InChI
    InChI=1S/C18H14Cl4N2O.HNO3/c19-12-4-5-13(17(22)8-12)18(9-24-7-6-23-11-24)25-10-14-15(20)2-1-3-16(14)21;2-1(3)4/h1-8,11,18H,9-10H2;(H,2,3,4)
    2.1.3 InChI Key
    NNGQLSIGRSTLLU-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC(=C(C(=C1)Cl)COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl.[N+](=O)(O)[O-]
    2.2 Other Identifiers
    2.2.1 UNII
    5AS8P3N30X
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 1-(2,4-dichloro Beta-(2,6-dichlorobenzyloxy)phenethyl) Imidazole

    2. Fazol

    3. Gyno Icaden

    4. Gyno-travogen

    5. Icaden

    6. Isoconazole

    7. R15454

    8. Travogyn

    2.3.2 Depositor-Supplied Synonyms

    1. 24168-96-5

    2. Travogyn

    3. Fazol

    4. Isoconazole (nitrate)

    5. Isoconazole Nitrate [jan]

    6. Adestan G 100

    7. R 15,454

    8. 5as8p3n30x

    9. 40036-10-0

    10. 24168-96-5 (nitrate)

    11. Travogen

    12. Imidazole, 1-(2,4-dichloro-beta-((2,6-dichlorobenzyl)oxy)phenethyl)-, Mononitrate

    13. Isoconazole Nitrate (jan)

    14. 1-(2-(2,4-dichlorophenyl)-2-((2,6-dichlorophenyl)methoxy)ethyl)-1h-imidazole Mononitrate

    15. 1-[2-(2,4-dichlorophenyl)-2-[(2,6-dichlorophenyl)methoxy]ethyl]-1h-imidazole Mononitrate

    16. R-15454

    17. Adestan G100

    18. Gyno-travogen

    19. 1-[2-(2,4-dichlorophenyl)-2-[(2,6-dichlorophenyl)methoxy]ethyl]-1h-imidazole; Nitric Acid

    20. 1-[2-(2,4-dichlorophenyl)-2-[(2,6-dichlorophenyl)methoxy]ethyl]imidazole;nitric Acid

    21. 1h-imidazole, 1-[2-(2,4-dichlorophenyl)-2-[(2,6-dichlorophenyl)methoxy]ethyl]-, Nitrate

    22. 1-(2-((2,6-dichlorobenzyl)oxy)-2-(2,4-dichlorophenyl)ethyl)-1h-imidazole Nitrate

    23. Einecs 246-051-4

    24. Unii-5as8p3n30x

    25. R-15,454

    26. Adestan-g (tn)

    27. 1-(2,4-dichloro-beta-(2,6-dichlorobenzyloxy)phenethyl)imidazole Nitrate

    28. 1-(2-((2,6-dichlorobenzyl)oxy)-2-(2,4-dichlorophenyl)ethyl)imidazole Nitrate

    29. 1h-imidazole, 1-(2-(2,4-dichlorophenyl)-2-((2,6-dichlorophenyl)methoxy)ethyl)-, Mononitrate

    30. Schembl364401

    31. Isoconazole Nitrate (travogen)

    32. Isoconazole Nitrate [mi]

    33. Dtxsid60946995

    34. Hms3656a14

    35. Hy-b1444

    36. Isoconazole Nitrate [mart.]

    37. Einecs 254-769-4

    38. Isoconazole Nitrate [who-dd]

    39. Mfcd01721647

    40. S2534

    41. Akos015895806

    42. Ccg-269535

    43. Cs-5151

    44. Ks-1175

    45. Isoconazole Nitrate [ep Impurity]

    46. Isoconazole Nitrate [ep Monograph]

    47. Ft-0654776

    48. I0834

    49. Sw196721-3

    50. D01480

    51. A817123

    52. R 15454

    53. J-015379

    54. Q27261756

    55. 1-[2-(2,4-dichlorophenyl)-2-[(2,6-dichlorophenyl)methoxy]ethyl]-imidazole Mononitrate

    56. 1-[2-(2,6-dichlorobenzyloxy)-2-(2,4-dichlorophenyl)ethyl]imidazole Nitrate

    2.4 Create Date
    2005-06-24
    3 Chemical and Physical Properties
    Molecular Weight 479.1 g/mol
    Molecular Formula C18H15Cl4N3O4
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count6
    Exact Mass478.978717 g/mol
    Monoisotopic Mass476.981667 g/mol
    Topological Polar Surface Area93.1 Ų
    Heavy Atom Count29
    Formal Charge0
    Complexity431
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Antifungal Agents

    Substances that destroy fungi by suppressing their ability to grow or reproduce. They differ from FUNGICIDES, INDUSTRIAL because they defend against fungi present in human or animal tissues. (See all compounds classified as Antifungal Agents.)