1-[2-[[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-[[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-[4-methyl-3-(m-tolylsulfamoyl)anilino]-2-oxo-ethyl]cyclohexanecarboxylic acid CAS Name: 1-[2-[4-methyl-3-[(3-methylphenyl)sulfamoyl]anilino]-2-oxoethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-[4-methyl-3-[(3-methylphenyl)sulfamoyl]anilino]-2-oxoethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-keto-2-[4-methyl-3-(m-tolylsulfamoyl)anilino]ethyl]cyclohexanecarboxylic acid Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)NC(=O)CC3(CCCCC3)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)NC(=O)CC3(CCCCC3)C(=O)O)C

InChI

InChI=1S/C23H28N2O5S/c1-16-7-6-8-19(13-16)25-31(29,30)20-14-18(10-9-17(20)2)24-21(26)15-23(22(27)28)11-4-3-5-12-23/h6-10,13-14,25H,3-5,11-12,15H2,1-2H3,(H,24,26)(H,27,28)