(2S)-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-oxidanylidene-1-(3-oxidanylidene-1H-2-benzofuran-1-yl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-oxidanylidene-1-(3-oxidanylidene-1H-2-benzofuran-1-yl)pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-5-oxo-1-(3-oxo-1H-isobenzofuran-1-yl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-5-oxo-1-(3-oxo-1H-2-benzofuran-1-yl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-5-keto-1-phthalidyl-pyrrolidine-2-carboxamide Formula: C22H18N2O7 MolecularWeight: 422.38752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C3CCC(=O)N3C4C5=CC=CC=C5C(=O)O4)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)[C@@H]3CCC(=O)N3C4C5=CC=CC=C5C(=O)O4)OCO2

InChI

InChI=1S/C22H18N2O7/c1-11(25)14-8-17-18(30-10-29-17)9-15(14)23-20(27)16-6-7-19(26)24(16)21-12-4-2-3-5-13(12)22(28)31-21/h2-5,8-9,16,21H,6-7,10H2,1H3,(H,23,27)/t16-,21?/m0/s1