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        当前地位: 九五至尊娱乐在线游戏 » 材料 » 化学物质数据库 » ZINC00030920 (2R)-1-(3,4-dihydro-2H-quinolin-1-yl)-2-(phenoxy)propan-1

        ZINC00030920 (2R)-1-(3,4-dihydro-2H-quinolin-1-yl)-2-(phenoxy)propan-1

        放大年夜字体  缩小字体 更新日期:2018-05-07  浏览次数:6
        九五至尊网址886868:ZINC00030920 (2R)-1-(3,4-dihydro-2H-quinolin-1-yl)-2-(phenoxy)propan-1-one,Canonical SMILES: CC(C(=O)N1CCCC2=CC=CC=C21)OC3=CC=CC=C3,Isomeric SMILES: C[C@H](C(=O)N1CCCC2=CC=CC=C21)OC3=CC=CC=C3,InChI: InChI=1/C18H19NO2/c1-14(21-16-10-3-2-4-11-16)18(20)
        [Synonyms]
        ZINC00030920
        [Structure]
        ZINC00030920 (2R)-1-(3,4-dihydro-2H-quinolin-1-yl)-2-(phenoxy)propan-1

        [ Properties Computed from Structure]
        Molecular Weight281.34896 [g/mol]
        Molecular FormulaC18H19NO2
        XLogP3.5
        H-Bond Donor0
        H-Bond Acceptor2
        Rotatable Bond Count3
        Exact Mass281.141579
        MonoIsotopic Mass281.141579
        Topological Polar Surface Area29.5
        Heavy Atom Count21
        Formal Charge0
        Complexity351
        Isotope Atom Count0
        Defined Atom StereoCenter Count1
        Undefined Atom StereoCenter Count0
        Defined Bond StereoCenter Count0
        Undefined Bond StereoCenter Count0
        Covalently-Bonded Unit Count1

        [ Descriptors Computed from Structure]
        IUPAC Name: (2R)-1-(3,4-dihydro-2H-quinolin-1-yl)-2-(phenoxy)propan-1-one
        Canonical SMILES: CC(C(=O)N1CCCC2=CC=CC=C21)OC3=CC=CC=C3
        Isomeric SMILES: C[C@H](C(=O)N1CCCC2=CC=CC=C21)OC3=CC=CC=C3
        InChI: InChI=1/C18H19NO2/c1-14(21-16-10-3-2-4-11-16)18(20)19-13-7-9-15-8-5-6-
        12-17(15)19/h2-6,8,10-12,14H,7,9,13H2,1H3/t14-/m1/s1

         
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