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  • [Synonyms]
    Propylene-bis-salicylamide
    N,N'-Trimethylenedisalicylamide
    Salicylamide, N,N'-trimethylenebis-
    NSC689436
    AIDS050685
    AIDS-050685
    BRN 2671500
    Benzamide, N,N'-1,3-propanediylbis(2-hydroxy-
    LS-144180
    N,N'-Bis(2-hydroxybenzoyl)-1,3-diaminopropane

    [Structure]

    [ Properties Computed from Structure]
    Molecular Weight314.33582 [g/mol]
    Molecular FormulaC17H18N2O4
    XLogP3.5
    H-Bond Donor4
    H-Bond Acceptor4
    Rotatable Bond Count6
    Tautomer Count25
    Exact Mass314.126657
    MonoIsotopic Mass314.126657
    Topological Polar Surface Area98.7
    Heavy Atom Count23
    Formal Charge0
    Complexity366
    Isotope Atom Count0
    Defined Atom StereoCenter Count0
    Undefined Atom StereoCenter Count0
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count0
    Covalently-Bonded Unit Count1

    [ Descriptors Computed from Structure]
    IUPAC Name: 2-hydroxy-N-[3-[(2-hydroxybenzoyl)amino]propyl]benzamide
    Canonical SMILES: C1=CC=C(C(=C1)C(=O)NCCCNC(=O)C2=CC=CC=C2O)O
    InChI: InChI=1/C17H18N2O4/c20-14-8-3-1-6-12(14)16(22)18-10-5-11-19-17(23)13-7-
    2-4-9-15(13)21/h1-4,6-9,20-21H,5,10-11H2,(H,18,22)(H,19,23)/f/h18-19H



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