N2-(1,3-benzodioxol-5-yl)-N1-(3-ethanoylphenyl)pyrrolidine-1,2-dicarboxamide

Systemtic Name: N2-(1,3-benzodioxol-5-yl)-N1-(3-ethanoylphenyl)pyrrolidine-1,2-dicarboxamide Openeye Name: N1-(3-acetylphenyl)-N2-(1,3-benzodioxol-5-yl)pyrrolidine-1,2-dicarboxamide CAS Name: N1-(3-acetylphenyl)-N2-(1,3-benzodioxol-5-yl)pyrrolidine-1,2-dicarboxamide IUPAC Name: 1-N-(3-acetylphenyl)-2-N-(1,3-benzodioxol-5-yl)pyrrolidine-1,2-dicarboxamide Traditional Name: N-(3-acetylphenyl)-N'-(1,3-benzodioxol-5-yl)pyrrolidine-1,2-dicarboxamide Formula: C21H21N3O5 MolecularWeight: 395.40854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)N2CCCC2C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)N2CCCC2C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21N3O5/c1-13(25)14-4-2-5-15(10-14)23-21(27)24-9-3-6-17(24)20(26)22-16-7-8-18-19(11-16)29-12-28-18/h2,4-5,7-8,10-11,17H,3,6,9,12H2,1H3,(H,22,26)(H,23,27)