[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] (3S)-1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] (3S)-1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] (3S)-1-(3,4-dimethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(3,4-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] (3S)-1-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(3,4-dimethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C21H20N2O6 MolecularWeight: 396.3933

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C[C@H](CC2=O)C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C21H20N2O6/c1-13-6-7-17(8-14(13)2)22-11-16(10-20(22)25)21(26)29-12-19(24)15-4-3-5-18(9-15)23(27)28/h3-9,16H,10-12H2,1-2H3/t16-/m0/s1