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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidine-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-oxo-1-(p-tolylmethyl)pyrrolidine-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-methylphenyl)methyl]-5-oxo-2-pyrrolidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxamide Traditional Name: 5-keto-1-(4-methylbenzyl)-N-piperonyl-pyrrolidine-2-carboxamide Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(CCC2=O)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(CCC2=O)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

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