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

Systemtic Name: [2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl] (3S)-1-(3-nitrophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-fluoroanilino)-2-oxo-ethyl] (3S)-1-(3-nitrophenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(3-nitrophenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-fluoroanilino)-2-oxoethyl] (3S)-1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(3-nitrophenyl)pyrrolidine-3-carboxylic acid [2-(4-fluoroanilino)-2-keto-ethyl] ester Formula: C19H16FN3O6 MolecularWeight: 401.345243

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1[C@@H](CN(C1=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C19H16FN3O6/c20-13-4-6-14(7-5-13)21-17(24)11-29-19(26)12-8-18(25)22(10-12)15-2-1-3-16(9-15)23(27)28/h1-7,9,12H,8,10-11H2,(H,21,24)/t12-/m0/s1