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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2C3=CC=CC=C3C(=O)N2CCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2C3=CC=CC=C3C(=O)N2CCC4=CC=CC=C4)OC

InChI

InChI=1S/C27H28N2O4/c1-32-23-13-12-20(18-24(23)33-2)14-16-28-26(30)25-21-10-6-7-11-22(21)27(31)29(25)17-15-19-8-4-3-5-9-19/h3-13,18,25H,14-17H2,1-2H3,(H,28,30)