208851 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 8 8 7 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 3 3 4 4 4 5 5 5 5 6 6 7 9 9 10 10 10 11 11 12 12 13 13 14 14 15 15 16 18 18 19 19 20 8 17 7 8 10 17 33 34 6 8 9 21 7 11 12 13 14 17 22 23 15 24 16 25 18 26 19 27 16 28 29 20 30 20 31 32 2 2 1 1 1 1 1 1 1 1 1 1 1 2 2 2 1 1 1 1 1 1 1 1 1 1 2 1 2 1 1 2 1 1 1 1 5 6 8 9 21 3 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 6.2619 3.3426 4.6783 4.6318 4.6783 3.732 3.732 5.2619 4.9889 4.9889 2.866 2.866 5.9674 4.3211 2 2 4.3211 6.2781 4.6318 5.6103 5.2908 5.3715 5.5359 2.866 2.866 6.3815 3.7144 1.4631 1.4631 6.8848 4.2177 5.8029 4.2177 5.2384 0.1276 -2.1657 -0.6771 -3.3224 0.9324 0.6276 -0.3724 0.1276 1.8829 -1.6276 1.1276 -0.8724 2.0891 2.6272 0.6276 -0.3724 -2.3719 3.0396 3.5777 3.7839 1.0286 -2.1155 -1.3356 1.7476 -1.4924 1.6276 2.4993 0.9376 -0.6824 3.1675 4.0392 4.3732 -3.7839 -3.4503 3 8 8 8 8 8 8 8 8 8 8 8 8 5 6 6 7 9 9 11 12 13 14 15 18 19 9 7 11 12 13 14 15 16 18 19 16 20 20 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 390 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 1 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 3 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371C07B3000000000000000000000000000000160000000306000000000000058014000001E00100000000D08C1980430C083400000880225525000820000210200088801886488086032C095B1942008609600C8C8071C88C08E80000000000200000000000000040000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-(2-oxo-3-phenyl-indolin-1-yl)acetamide IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-(2-oxo-3-phenyl-3H-indol-1-yl)acetamide IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-(2-oxo-3-phenyl-3<I>H</I>-indol-1-yl)acetamide IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-(2-oxo-3-phenyl-3H-indol-1-yl)acetamide IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-(2-oxidanylidene-3-phenyl-3H-indol-1-yl)ethanamide IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-(2-keto-3-phenyl-indolin-1-yl)acetamide InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C16H14N2O2/c17-14(19)10-18-13-9-5-4-8-12(13)15(16(18)20)11-6-2-1-3-7-11/h1-9,15H,10H2,(H2,17,19) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 MVZYGLQQNPFARE-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 1.6 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 266.105527694 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C16H14N2O2 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 266.29 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1=CC=C(C=C1)C2C3=CC=CC=C3N(C2=O)CC(=O)N SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1=CC=C(C=C1)C2C3=CC=CC=C3N(C2=O)CC(=O)N Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 63.4 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 266.105527694 20 1 0 1 0 0 0 0 1 -1