[2-[(4-methyl-3-sulfamoyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-butylcyclohexane-1-carboxylate

Systemtic Name: [2-[(4-methyl-3-sulfamoyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-butylcyclohexane-1-carboxylate Openeye Name: [2-(4-methyl-3-sulfamoyl-anilino)-2-oxo-ethyl] 4-butylcyclohexanecarboxylate CAS Name: 4-butyl-1-cyclohexanecarboxylic acid [2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl] 4-butylcyclohexane-1-carboxylate Traditional Name: 4-butylcyclohexanecarboxylic acid [2-keto-2-(4-methyl-3-sulfamoyl-anilino)ethyl] ester Formula: C20H30N2O5S MolecularWeight: 410.5276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)OCC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)OCC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N

InChI

InChI=1S/C20H30N2O5S/c1-3-4-5-15-7-9-16(10-8-15)20(24)27-13-19(23)22-17-11-6-14(2)18(12-17)28(21,25)26/h6,11-12,15-16H,3-5,7-10,13H2,1-2H3,(H,22,23)(H2,21,25,26)