(2S)-N-[(4-chlorophenyl)methyl]-1-(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)-5-oxidanylidene-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(4-chlorophenyl)methyl]-1-(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)-5-oxidanylidene-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(4-chlorophenyl)methyl]-1-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-5-oxo-pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(4-chlorophenyl)methyl]-1-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-5-oxo-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(4-chlorophenyl)methyl]-1-(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)-5-oxopyrrolidine-2-carboxamide Traditional Name: (2S)-N-(4-chlorobenzyl)-5-keto-1-(3-keto-4,5-dimethoxy-phthalan-1-yl)pyrrolidine-2-carboxamide Formula: C22H21ClN2O6 MolecularWeight: 444.86494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)N3C(CCC3=O)C(=O)NCC4=CC=C(C=C4)Cl)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)N3[C@@H](CCC3=O)C(=O)NCC4=CC=C(C=C4)Cl)OC

InChI

InChI=1S/C22H21ClN2O6/c1-29-16-9-7-14-18(19(16)30-2)22(28)31-21(14)25-15(8-10-17(25)26)20(27)24-11-12-3-5-13(23)6-4-12/h3-7,9,15,21H,8,10-11H2,1-2H3,(H,24,27)/t15-,21?/m0/s1