68407280 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 17 8 7 7 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 2 3 3 3 4 4 4 5 5 5 6 6 7 9 9 10 10 11 11 12 12 13 14 15 16 16 17 17 18 18 19 13 8 7 8 20 15 29 30 6 7 10 8 9 12 11 21 13 22 15 16 14 23 14 24 17 18 25 19 26 19 27 28 1 2 1 1 1 1 1 1 1 2 1 1 2 1 1 1 2 1 1 2 2 1 1 1 2 1 1 1 1 2 1 1 6 5 8 9 11 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 2 7.1279 5.5443 6.4763 4.5981 5.5443 4.5981 6.1279 5.855 3.732 6.8335 3.732 2.866 2.866 7.1441 7.5013 8.1226 8.4798 8.7905 5.7369 5.4409 3.732 3.732 2.3291 7.3087 8.3152 8.8939 9.3972 6.6689 5.8696 -0.4258 -1.4258 -2.2305 2.2305 -0.9258 -0.621 -1.9258 -1.4258 0.3295 -0.4258 0.5357 -2.4258 -0.9258 -1.9258 1.4862 -0.2086 1.6924 -0.0024 0.9481 -2.8198 0.7909 0.1942 -3.0458 -2.2358 -0.7979 2.2818 -0.4639 1.076 2.8198 2.1027 8 8 1 8 8 8 8 8 8 8 8 8 8 5 5 6 7 10 11 11 12 13 15 16 17 18 7 10 9 12 13 15 16 14 14 17 18 19 19 0 Compound Canonicalized 5 2012.11.26 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 396 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 2 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 2 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 1 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 00000371C0732000040000000000000000000000000160000000306000000000000058014000001E02100000000C0A81982030C082C000008802255250008200002107000888010066C8082032C19791842008609400C8C9871C88808E00004020000200000000804000040000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 3-[(2-aminophenyl)methylene]-5-chloro-indolin-2-one IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 3-[(2-aminophenyl)methylidene]-5-chloro-1H-indol-2-one IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 3-[(2-aminophenyl)methylidene]-5-chloro-1<I>H</I>-indol-2-one IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 3-[(2-aminophenyl)methylidene]-5-chloro-1H-indol-2-one IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 3-[(2-aminophenyl)methylidene]-5-chloranyl-1H-indol-2-one IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 3-(2-aminobenzylidene)-5-chloro-oxindole InChI Standard 1 1.0.6 InChI iupac.org 2021.05.07 InChI=1S/C15H11ClN2O/c16-10-5-6-14-11(8-10)12(15(19)18-14)7-9-3-1-2-4-13(9)17/h1-8H,17H2,(H,18,19) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.05.07 HLPBCGBRFKIRRP-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.05.07 2.8 Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 270.0559907 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 C15H11ClN2O Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 270.71 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.05.07 C1=CC=C(C(=C1)C=C2C3=C(C=CC(=C3)Cl)NC2=O)N SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.05.07 C1=CC=C(C(=C1)C=C2C3=C(C=CC(=C3)Cl)NC2=O)N Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 55.1 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 270.0559907 19 0 0 0 1 0 1 0 1 -1