N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-5-oxo-1-phenethyl-pyrrolidine-3-carboxamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-5-oxo-1-phenethyl-3-pyrrolidinecarboxamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-5-oxo-1-phenethylpyrrolidine-3-carboxamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-5-keto-1-phenethyl-pyrrolidine-3-carboxamide Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C3CC(=O)N(C3)CCC4=CC=CC=C4)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)C3CC(=O)N(C3)CCC4=CC=CC=C4)OCO2

InChI

InChI=1S/C22H22N2O5/c1-14(25)17-10-19-20(29-13-28-19)11-18(17)23-22(27)16-9-21(26)24(12-16)8-7-15-5-3-2-4-6-15/h2-6,10-11,16H,7-9,12-13H2,1H3,(H,23,27)