methyl 1-(4-methoxy-2-nitro-phenyl)sulfonyl-2-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-(4-methoxy-2-nitro-phenyl)sulfonyl-2-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: methyl 2-hydroxy-1-(4-methoxy-2-nitro-phenyl)sulfonyl-pyrrolidine-2-carboxylate CAS Name: 2-hydroxy-1-(4-methoxy-2-nitrophenyl)sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-hydroxy-1-(4-methoxy-2-nitrophenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 2-hydroxy-1-(4-methoxy-2-nitro-phenyl)sulfonyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C13H16N2O8S MolecularWeight: 360.33974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S(=O)(=O)N2CCCC2(C(=O)OC)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)S(=O)(=O)N2CCCC2(C(=O)OC)O)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O8S/c1-22-9-4-5-11(10(8-9)15(18)19)24(20,21)14-7-3-6-13(14,17)12(16)23-2/h4-5,8,17H,3,6-7H2,1-2H3