2-(2-cyanoethyl)-N-[[2-methyl-4-(trifluoromethyloxy)phenyl]methyl]-3-oxidanylidene-1H-isoindole-1-carboxamide

Systemtic Name: 2-(2-cyanoethyl)-N-[[2-methyl-4-(trifluoromethyloxy)phenyl]methyl]-3-oxidanylidene-1H-isoindole-1-carboxamide Openeye Name: 2-(2-cyanoethyl)-N-[[2-methyl-4-(trifluoromethoxy)phenyl]methyl]-3-oxo-isoindoline-1-carboxamide CAS Name: 2-(2-cyanoethyl)-N-[[2-methyl-4-(trifluoromethoxy)phenyl]methyl]-3-oxo-1H-isoindole-1-carboxamide IUPAC Name: 2-(2-cyanoethyl)-N-[[2-methyl-4-(trifluoromethoxy)phenyl]methyl]-3-oxo-1H-isoindole-1-carboxamide Traditional Name: 2-(2-cyanoethyl)-3-keto-N-[2-methyl-4-(trifluoromethoxy)benzyl]isoindoline-1-carboxamide Formula: C21H18F3N3O3 MolecularWeight: 417.38113

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(F)(F)F)CNC(=O)C2C3=CC=CC=C3C(=O)N2CCC#N

Isomeric SMILES

CC1=C(C=CC(=C1)OC(F)(F)F)CNC(=O)C2C3=CC=CC=C3C(=O)N2CCC#N

InChI

InChI=1S/C21H18F3N3O3/c1-13-11-15(30-21(22,23)24)8-7-14(13)12-26-19(28)18-16-5-2-3-6-17(16)20(29)27(18)10-4-9-25/h2-3,5-8,11,18H,4,10,12H2,1H3,(H,26,28)