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

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] (3S)-5-oxidanylidene-1-(4-phenyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxylate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] (3S)-5-oxo-1-(4-phenylthiazol-2-yl)pyrrolidine-3-carboxylate CAS Name: (3S)-5-oxo-1-(4-phenyl-2-thiazolyl)-3-pyrrolidinecarboxylic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] (3S)-5-oxo-1-(4-phenyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(4-phenylthiazol-2-yl)pyrrolidine-3-carboxylic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C22H17N3O6S MolecularWeight: 451.45188

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=NC(=CS2)C3=CC=CC=C3)C(=O)OCC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1[C@@H](CN(C1=O)C2=NC(=CS2)C3=CC=CC=C3)C(=O)OCC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O6S/c26-19(15-7-4-8-17(9-15)25(29)30)12-31-21(28)16-10-20(27)24(11-16)22-23-18(13-32-22)14-5-2-1-3-6-14/h1-9,13,16H,10-12H2/t16-/m0/s1