methyl 1-[4-(methylsulfamoyl)-2-nitro-phenyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[4-(methylsulfamoyl)-2-nitro-phenyl]piperidine-4-carboxylate Openeye Name: methyl 1-[4-(methylsulfamoyl)-2-nitro-phenyl]piperidine-4-carboxylate CAS Name: 1-[4-(methylsulfamoyl)-2-nitrophenyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-(methylsulfamoyl)-2-nitrophenyl]piperidine-4-carboxylate Traditional Name: 1-[4-(methylsulfamoyl)-2-nitro-phenyl]isonipecotic acid methyl ester Formula: C14H19N3O6S MolecularWeight: 357.38216

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)N2CCC(CC2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)N2CCC(CC2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O6S/c1-15-24(21,22)11-3-4-12(13(9-11)17(19)20)16-7-5-10(6-8-16)14(18)23-2/h3-4,9-10,15H,5-8H2,1-2H3