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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 » ZINC00030909 (2R)-N-cyclohexyl-N-ethyl-2-(phenoxy)propanamide,Canonica

            ZINC00030909 (2R)-N-cyclohexyl-N-ethyl-2-(phenoxy)propanamide,Canonica

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            九五至尊网址886868:ZINC00030909 (2R)-N-cyclohexyl-N-ethyl-2-(phenoxy)propanamide,Canonical SMILES: CCN(C1CCCCC1)C(=O)C(C)OC2=CC=CC=C2,Isomeric SMILES: CCN(C1CCCCC1)C(=O)[C@@H](C)OC2=CC=CC=C2,InChI: InChI=1/C17H25NO2/c1-3-18(15-10-6-4-7-11-15)17(19)14(2)20-16-12-8-5-9-,
            [Synonyms]
            ZINC00030909
            [Structure]
            ZINC00030909 (2R)-N-cyclohexyl-N-ethyl-2-(phenoxy)propanamide,Canonica

            [ Properties Computed from Structure]
            Molecular Weight275.3859 [g/mol]
            Molecular FormulaC17H25NO2
            XLogP4
            H-Bond Donor0
            H-Bond Acceptor2
            Rotatable Bond Count5
            Exact Mass275.188529
            MonoIsotopic Mass275.188529
            Topological Polar Surface Area29.5
            Heavy Atom Count20
            Formal Charge0
            Complexity293
            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)-N-cyclohexyl-N-ethyl-2-(phenoxy)propanamide
            Canonical SMILES: CCN(C1CCCCC1)C(=O)C(C)OC2=CC=CC=C2
            Isomeric SMILES: CCN(C1CCCCC1)C(=O)[C@@H](C)OC2=CC=CC=C2
            InChI: InChI=1/C17H25NO2/c1-3-18(15-10-6-4-7-11-15)17(19)14(2)20-16-12-8-5-9-
            13-16/h5,8-9,12-15H,3-4,6-7,10-11H2,1-2H3/t14-/m1/s1

             
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