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

Systemtic Name: 2-(cyanomethyl)-3-oxidanylidene-N-[[4-(trifluoromethyloxy)phenyl]methyl]-1H-isoindole-1-carboxamide Openeye Name: 2-(cyanomethyl)-3-oxo-N-[[4-(trifluoromethoxy)phenyl]methyl]isoindoline-1-carboxamide CAS Name: 2-(cyanomethyl)-3-oxo-N-[[4-(trifluoromethoxy)phenyl]methyl]-1H-isoindole-1-carboxamide IUPAC Name: 2-(cyanomethyl)-3-oxo-N-[[4-(trifluoromethoxy)phenyl]methyl]-1H-isoindole-1-carboxamide Traditional Name: 2-(cyanomethyl)-3-keto-N-[4-(trifluoromethoxy)benzyl]isoindoline-1-carboxamide Formula: C19H14F3N3O3 MolecularWeight: 389.32797

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(N(C2=O)CC#N)C(=O)NCC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(N(C2=O)CC#N)C(=O)NCC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C19H14F3N3O3/c20-19(21,22)28-13-7-5-12(6-8-13)11-24-17(26)16-14-3-1-2-4-15(14)18(27)25(16)10-9-23/h1-8,16H,10-11H2,(H,24,26)