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  • [Synonyms]

    [Structure]

    [ Properties Computed from Structure]
    Molecular Weight327.266703 [g/mol]
    Molecular FormulaC16H10FN3O4
    XLogP0
    H-Bond Donor2
    H-Bond Acceptor7
    Rotatable Bond Count3
    Exact Mass327.065534
    MonoIsotopic Mass327.065534
    Topological Polar Surface Area103
    Heavy Atom Count24
    Formal Charge0
    Complexity726
    Isotope Atom Count0
    Defined Atom StereoCenter Count0
    Undefined Atom StereoCenter Count0
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count1
    Covalently-Bonded Unit Count1

    [ Descriptors Computed from Structure]
    IUPAC Name: 7-(dihydroxyamino)-3-[2-(4-fluorophenyl)-2-oxoethylidene]quinoxalin-2-
    one
    Canonical SMILES: C1=CC(=CC=C1C(=O)C=C2C(=O)N=C3C=C(C=CC3=N2)N(O)O)F
    InChI: InChI=1/C16H10FN3O4/c17-10-3-1-9(2-4-10)15(21)8-14-16(22)19-13-7-11(20
    (23)24)5-6-12(13)18-14/h1-8,23-24H



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