(4-methanoylphenyl) (3S)-1-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (4-methanoylphenyl) (3S)-1-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (4-formylphenyl) (3S)-1-(4-methyl-3-nitro-phenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(4-methyl-3-nitrophenyl)-5-oxo-3-pyrrolidinecarboxylic acid (4-formylphenyl) ester IUPAC Name: (4-formylphenyl) (3S)-1-(4-methyl-3-nitrophenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(4-methyl-3-nitro-phenyl)pyrrolidine-3-carboxylic acid (4-formylphenyl) ester Formula: C19H16N2O6 MolecularWeight: 368.34014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)OC3=CC=C(C=C3)C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)N2C[C@H](CC2=O)C(=O)OC3=CC=C(C=C3)C=O)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O6/c1-12-2-5-15(9-17(12)21(25)26)20-10-14(8-18(20)23)19(24)27-16-6-3-13(11-22)4-7-16/h2-7,9,11,14H,8,10H2,1H3/t14-/m0/s1