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    Benorilate

    INTERMEDIATES

    FINISHED DOSAGE FORMULATIONS

    PharmaCompass
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    2D Structure
    Also known as: 5003-48-5, Benorylate, 4-acetamidophenyl 2-acetoxybenzoate, Salipran, Benoral, Benortan
    Molecular Formula
    C17H15NO5
    Molecular Weight
    313.30  g/mol
    InChI Key
    FEJKLNWAOXSSNR-UHFFFAOYSA-N
    FDA UNII
    W1QX9DV96G
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (4-acetamidophenyl) 2-acetyloxybenzoate
    2.1.2 InChI
    InChI=1S/C17H15NO5/c1-11(19)18-13-7-9-14(10-8-13)23-17(21)15-5-3-4-6-16(15)22-12(2)20/h3-10H,1-2H3,(H,18,19)
    2.1.3 InChI Key
    FEJKLNWAOXSSNR-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2OC(=O)C
    2.2 Other Identifiers
    2.2.1 UNII
    W1QX9DV96G
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 2-acetoxy-4'-acetaminophenylbenzoate

    2. 4-acetamidophenyl-o-acetylsalicylate

    3. Benoral

    4. Benorylate

    5. Salipran

    2.3.2 Depositor-Supplied Synonyms

    1. 5003-48-5

    2. Benorylate

    3. 4-acetamidophenyl 2-acetoxybenzoate

    4. Salipran

    5. Benoral

    6. Benortan

    7. Fenasprate

    8. Fenasparate

    9. Aspirin Acetaminophen Ester

    10. Benorilato

    11. Win 11450

    12. Benzoic Acid, 2-(acetyloxy)-, 4-(acetylamino)phenyl Ester

    13. 4-acetamidophenyl Salicylate Acetate

    14. P-acetamidophenyl Acetylsalicylate

    15. P-n-acetylaminophenylacetylsalicylate

    16. To 125

    17. (4-acetamidophenyl) 2-acetyloxybenzoate

    18. 2-acetoxy-4'-(acetamino)phenylbenzoate

    19. 4'-(acetamido)phenyl-2-acetoxybenzoate

    20. W1qx9dv96g

    21. 2-(acetyloxy)benzoic Acid 4-(acetylamino)phenyl Ester

    22. Benorilate (inn)

    23. Win-11450

    24. Salicylic Acid, Acetate, Ester With 4'-hydroxyacetanilide

    25. Ncgc00167468-01

    26. Benorilate 100 Microg/ml In Acetonitrile

    27. Benorilate [inn]

    28. 4-(acetylamino)phenyl 2-(acetyloxy)benzoate

    29. Dsstox_cid_2649

    30. Dsstox_rid_76674

    31. Dsstox_gsid_22649

    32. Benorilato [spanish]

    33. Benorilatum

    34. Quinexin

    35. Benorilatum [inn-latin]

    36. Benorilato [inn-spanish]

    37. Cas-5003-48-5

    38. Ccris 1739

    39. Einecs 225-674-5

    40. Unii-w1qx9dv96g

    41. Brn 2166628

    42. Benorilate [inn:ban:dcf]

    43. Benorilate,(s)

    44. Benorylate [mi]

    45. Benorilate [mart.]

    46. Benorilate [who-dd]

    47. Schembl25167

    48. 2-(acetyloxy)-benzoicacid 4-(acetylamino)phenylester

    49. Chembl162036

    50. Zinc1003

    51. Dtxsid5022649

    52. Chebi:135340

    53. Bcpp000346

    54. Bcp13353

    55. Tox21_112472

    56. Mfcd00864257

    57. S5043

    58. Akos016010035

    59. Tox21_112472_1

    60. Ccg-267615

    61. Db13657

    62. Ks-5206

    63. Ncgc00167468-02

    64. Ac-12036

    65. As-13290

    66. Bcp0726000190

    67. Hy-107795

    68. Cs-0030669

    69. Ft-0740917

    70. 4-(acetylamino)phenyl 2-(acetyloxy)benzoate #

    71. A18816

    72. D07291

    73. Q373243

    74. Sr-01000944978

    75. J-514276

    76. Sr-01000944978-1

    2.4 Create Date
    2005-03-27
    3 Chemical and Physical Properties
    Molecular Weight 313.30 g/mol
    Molecular Formula C17H15NO5
    XLogP32.2
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count6
    Exact Mass313.09502258 g/mol
    Monoisotopic Mass313.09502258 g/mol
    Topological Polar Surface Area81.7 Ų
    Heavy Atom Count23
    Formal Charge0
    Complexity442
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Anti-Inflammatory Agents, Non-Steroidal

    Anti-inflammatory agents that are non-steroidal in nature. In addition to anti-inflammatory actions, they have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. Inhibition of prostaglandin synthesis accounts for their analgesic, antipyretic, and platelet-inhibitory actions; other mechanisms may contribute to their anti-inflammatory effects. (See all compounds classified as Anti-Inflammatory Agents, Non-Steroidal.)

    4.2 ATC Code

    N - Nervous system

    N02 - Analgesics

    N02B - Other analgesics and antipyretics

    N02BA - Salicylic acid and derivatives

    N02BA10 - Benorilate