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

Systemtic Name: (2-methoxyphenyl) (3S)-1-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (2-methoxyphenyl) (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 (2-methoxyphenyl) ester IUPAC Name: (2-methoxyphenyl) (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 (2-methoxyphenyl) ester Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)OC3=CC=CC=C3OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)N2C[C@H](CC2=O)C(=O)OC3=CC=CC=C3OC)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O6/c1-12-7-8-14(10-15(12)21(24)25)20-11-13(9-18(20)22)19(23)27-17-6-4-3-5-16(17)26-2/h3-8,10,13H,9,11H2,1-2H3/t13-/m0/s1