1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-N-[3-(propanoylamino)phenyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-N-[3-(propanoylamino)phenyl]pyrrolidine-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-yl)-5-oxo-N-[3-(propanoylamino)phenyl]pyrrolidine-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-yl)-5-oxo-N-[3-(1-oxopropylamino)phenyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-5-oxo-N-[3-(propanoylamino)phenyl]pyrrolidine-3-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-yl)-5-keto-N-(3-propionamidophenyl)pyrrolidine-3-carboxamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC(=C1)NC(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC(=O)NC1=CC=CC(=C1)NC(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21N3O5/c1-2-19(25)22-14-4-3-5-15(9-14)23-21(27)13-8-20(26)24(11-13)16-6-7-17-18(10-16)29-12-28-17/h3-7,9-10,13H,2,8,11-12H2,1H3,(H,22,25)(H,23,27)