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  • [Synonyms]

    [Structure]

    [ Properties Computed from Structure]
    Molecular Weight281.34896 [g/mol]
    Molecular FormulaC18H19NO2
    XLogP4.2
    H-Bond Donor0
    H-Bond Acceptor3
    Rotatable Bond Count7
    Exact Mass281.141579
    MonoIsotopic Mass281.141579
    Topological Polar Surface Area29.5
    Heavy Atom Count21
    Formal Charge0
    Complexity308
    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: methyl 3-(bis(phenylmethyl)amino)prop-2-enoate
    Canonical SMILES: COC(=O)C=CN(CC1=CC=CC=C1)CC2=CC=CC=C2
    InChI: InChI=1/C18H19NO2/c1-21-18(20)12-13-19(14-16-8-4-2-5-9-16)15-17-10-6-3-
    7-11-17/h2-13H,14-15H2,1H3



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