N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-5-oxo-1-phenethyl-pyrrolidine-3-carboxamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]phenyl]-5-oxo-1-phenethyl-3-pyrrolidinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-5-oxo-1-phenethylpyrrolidine-3-carboxamide Traditional Name: 5-keto-1-phenethyl-N-[2-(piperonylcarbamoyl)phenyl]pyrrolidine-3-carboxamide Formula: C28H27N3O5 MolecularWeight: 485.53108

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CCC2=CC=CC=C2)C(=O)NC3=CC=CC=C3C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C(CN(C1=O)CCC2=CC=CC=C2)C(=O)NC3=CC=CC=C3C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H27N3O5/c32-26-15-21(17-31(26)13-12-19-6-2-1-3-7-19)27(33)30-23-9-5-4-8-22(23)28(34)29-16-20-10-11-24-25(14-20)36-18-35-24/h1-11,14,21H,12-13,15-18H2,(H,29,34)(H,30,33)