[2-[[4-(dimethylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-butylcyclohexane-1-carboxylate

Systemtic Name: [2-[[4-(dimethylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-butylcyclohexane-1-carboxylate Openeye Name: [2-[4-(dimethylsulfamoyl)anilino]-2-oxo-ethyl] 4-butylcyclohexanecarboxylate CAS Name: 4-butyl-1-cyclohexanecarboxylic acid [2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl] 4-butylcyclohexane-1-carboxylate Traditional Name: 4-butylcyclohexanecarboxylic acid [2-[4-(dimethylsulfamoyl)anilino]-2-keto-ethyl] ester Formula: C21H32N2O5S MolecularWeight: 424.55418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N2O5S/c1-4-5-6-16-7-9-17(10-8-16)21(25)28-15-20(24)22-18-11-13-19(14-12-18)29(26,27)23(2)3/h11-14,16-17H,4-10,15H2,1-3H3,(H,22,24)