N-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxidanylidene-2-(1-phenylethyl)-1H-isoindole-1-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxidanylidene-2-(1-phenylethyl)-1H-isoindole-1-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxo-2-(1-phenylethyl)isoindoline-1-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxo-2-(1-phenylethyl)-1H-isoindole-1-carboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxo-2-(1-phenylethyl)-1H-isoindole-1-carboxamide Traditional Name: N-homoveratryl-3-keto-2-(1-phenylethyl)isoindoline-1-carboxamide Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(C3=CC=CC=C3C2=O)C(=O)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(C3=CC=CC=C3C2=O)C(=O)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H28N2O4/c1-18(20-9-5-4-6-10-20)29-25(21-11-7-8-12-22(21)27(29)31)26(30)28-16-15-19-13-14-23(32-2)24(17-19)33-3/h4-14,17-18,25H,15-16H2,1-3H3,(H,28,30)