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  • [Synonyms]
    Substanz NR. 335
    O-Benzhydryldibutylaminoethanol hydrochloride
    LS-68052
    N,N-Dibutyl-2-(diphenylmethoxy)ethylamine hydrochloride
    beta-Dibutylaminoaethyl-benzhydrilaether hydrochlorid [German]
    Ethanamine, N,N-dibutyl-2-(diphenylmethoxy)-, hydrochloride
    ETHYLAMINE, N,N-DIBUTYL-2-(DIPHENYLMETHOXY)-, HYDROCHLORIDE
    101418-27-3

    [Structure]

    [ Properties Computed from Structure]
    Molecular Weight375.97516 [g/mol]
    Molecular FormulaC23H34ClNO
    H-Bond Donor1
    H-Bond Acceptor2
    Rotatable Bond Count12
    Exact Mass375.232892
    MonoIsotopic Mass375.232892
    Topological Polar Surface Area13.7
    Heavy Atom Count26
    Formal Charge0
    Complexity281
    Isotope Atom Count0
    Defined Atom StereoCenter Count0
    Undefined Atom StereoCenter Count0
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count0
    Covalently-Bonded Unit Count2

    [ Descriptors Computed from Structure]
    IUPAC Name: 2-benzhydryloxyethyl-dibutylazanium chloride
    Canonical SMILES: CCCC[NH+](CCCC)CCOC(C1=CC=CC=C1)C2=CC=CC=C2.[Cl-]
    InChI: InChI=1/C23H33NO.ClH/c1-3-5-17-24(18-6-4-2)19-20-25-23(21-13-9-7-10-14-
    21)22-15-11-8-12-16-22;/h7-16,23H,3-6,17-20H2,
    1-2H3;1H/fC23H34NO.Cl/h24H;1h/q+1;-1



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