1-[2-[[2-methyl-5-[(3-methylphenyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-[[2-methyl-5-[(3-methylphenyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-[2-methyl-5-(m-tolylsulfamoyl)anilino]-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-[2-methyl-5-[(3-methylphenyl)sulfamoyl]anilino]-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-[2-methyl-5-[(3-methylphenyl)sulfamoyl]anilino]-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-keto-2-[2-methyl-5-(m-tolylsulfamoyl)anilino]ethyl]cycloheptanecarboxylic acid Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)NC(=O)CC3(CCCCCC3)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)NC(=O)CC3(CCCCCC3)C(=O)O

InChI

InChI=1S/C24H30N2O5S/c1-17-8-7-9-19(14-17)26-32(30,31)20-11-10-18(2)21(15-20)25-22(27)16-24(23(28)29)12-5-3-4-6-13-24/h7-11,14-15,26H,3-6,12-13,16H2,1-2H3,(H,25,27)(H,28,29)