[2-[[2-[cyclohexyl(methyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 4-azanyl-3-nitro-benzoate

Systemtic Name: [2-[[2-[cyclohexyl(methyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 4-azanyl-3-nitro-benzoate Openeye Name: [2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxo-ethyl] 4-amino-3-nitro-benzoate CAS Name: 4-amino-3-nitrobenzoic acid [2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 4-amino-3-nitrobenzoate Traditional Name: 4-amino-3-nitro-benzoic acid [2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-keto-ethyl] ester Formula: C22H26N4O7S MolecularWeight: 490.52944

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O7S/c1-25(16-7-3-2-4-8-16)34(31,32)20-10-6-5-9-18(20)24-21(27)14-33-22(28)15-11-12-17(23)19(13-15)26(29)30/h5-6,9-13,16H,2-4,7-8,14,23H2,1H3,(H,24,27)