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            当前地位: 新太阳城网址 » 材料 » 化学物质数据库 » CBMicro_044666,Oprea1_257309,Oprea1_757861,MLS000572608,STK251720,ZINC

            CBMicro_044666,Oprea1_257309,Oprea1_757861,MLS000572608,STK251720,ZINC

            放大年夜字体  缩小字体 更新日期:2018-05-07  浏览次数:5
            太阳城集团网址大全:CBMicro_044666,Oprea1_257309,Oprea1_757861,MLS000572608,STK251720,ZINC00449227,SMR000194107,BIM-0044746.P001,N-2-biphenylyl-2-(2-methylphenoxy)acetamide, 2-(2-methylphenoxy)-N-(2-phenylphenyl)acetamide,Canonical SMILES: CC1=CC=CC=C1OCC(=O)NC2=CC=CC=C
            [Synonyms]
            CBMicro_044666
            Oprea1_257309
            Oprea1_757861
            MLS000572608
            STK251720
            ZINC00449227
            SMR000194107
            BIM-0044746.P001
            N-2-biphenylyl-2-(2-methylphenoxy)acetamide

            [Structure]
            CBMicro_044666,Oprea1_257309,Oprea1_757861,MLS000572608,STK251720,ZINC

            [ Properties Computed from Structure]
            Molecular Weight317.38106 [g/mol]
            Molecular FormulaC21H19NO2
            XLogP4.8
            H-Bond Donor1
            H-Bond Acceptor2
            Rotatable Bond Count5
            Tautomer Count2
            Exact Mass317.141579
            MonoIsotopic Mass317.141579
            Topological Polar Surface Area38.3
            Heavy Atom Count24
            Formal Charge0
            Complexity391
            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-(2-methylphenoxy)-N-(2-phenylphenyl)acetamide
            Canonical SMILES: CC1=CC=CC=C1OCC(=O)NC2=CC=CC=C2C3=CC=CC=C3
            InChI: InChI=1/C21H19NO2/c1-16-9-5-8-14-20(16)24-15-21(23)22-19-13-7-6-12-18
            (19)17-10-3-2-4-11-17/h2-14H,15H2,1H3,(H,22,23)/f/h22H

             
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