1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-methyl-3-nitro-phenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-methyl-3-nitrophenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-methyl-3-nitrophenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-homoveratryl-5-keto-N-(4-methyl-3-nitro-phenyl)pyrrolidine-3-carboxamide Formula: C22H25N3O6 MolecularWeight: 427.4504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC(=O)N(C2)CCC3=CC(=C(C=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CC(=O)N(C2)CCC3=CC(=C(C=C3)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O6/c1-14-4-6-17(12-18(14)25(28)29)23-22(27)16-11-21(26)24(13-16)9-8-15-5-7-19(30-2)20(10-15)31-3/h4-7,10,12,16H,8-9,11,13H2,1-3H3,(H,23,27)