[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 1-(4-nitrophenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: [2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 1-(4-nitrophenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: [2-(4-chloro-3-nitro-anilino)-2-oxo-ethyl] 4-hydroxy-1-(4-nitrophenyl)sulfonyl-pyrrolidine-2-carboxylate CAS Name: 4-hydroxy-1-(4-nitrophenyl)sulfonyl-2-pyrrolidinecarboxylic acid [2-(4-chloro-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-3-nitroanilino)-2-oxoethyl] 4-hydroxy-1-(4-nitrophenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 4-hydroxy-1-nosyl-pyrrolidine-2-carboxylic acid [2-(4-chloro-3-nitro-anilino)-2-keto-ethyl] ester Formula: C19H17ClN4O10S MolecularWeight: 528.87708

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)OCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1C(CN(C1C(=O)OCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C19H17ClN4O10S/c20-15-6-1-11(7-16(15)24(30)31)21-18(26)10-34-19(27)17-8-13(25)9-22(17)35(32,33)14-4-2-12(3-5-14)23(28)29/h1-7,13,17,25H,8-10H2,(H,21,26)