[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] (3R)-1-(4-ethoxycarbonylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] (3R)-1-(4-ethoxycarbonylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] (3R)-1-(4-ethoxycarbonylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-(4-ethoxycarbonylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] (3R)-1-(4-ethoxycarbonylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-1-(4-carbethoxyphenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C22H20N2O8 MolecularWeight: 440.4028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C[C@@H](CC2=O)C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O8/c1-2-31-21(27)14-6-8-17(9-7-14)23-12-16(11-20(23)26)22(28)32-13-19(25)15-4-3-5-18(10-15)24(29)30/h3-10,16H,2,11-13H2,1H3/t16-/m1/s1