(4-nitrophenyl) (3S)-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (4-nitrophenyl) (3S)-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (4-nitrophenyl) (3S)-1-(3-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) (3S)-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid (4-nitrophenyl) ester Formula: C18H16N2O6 MolecularWeight: 356.32944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC(CC2=O)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)N2C[C@H](CC2=O)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O6/c1-25-16-4-2-3-14(10-16)19-11-12(9-17(19)21)18(22)26-15-7-5-13(6-8-15)20(23)24/h2-8,10,12H,9,11H2,1H3/t12-/m0/s1