N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-oxo-1-(p-tolyl)pyrrolidine-3-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(4-methylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-homopiperonyl-5-keto-1-(p-tolyl)pyrrolidine-3-carboxamide Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N2O4/c1-14-2-5-17(6-3-14)23-12-16(11-20(23)24)21(25)22-9-8-15-4-7-18-19(10-15)27-13-26-18/h2-7,10,16H,8-9,11-13H2,1H3,(H,22,25)