cyclohexyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzenesulfonate

Systemtic Name: cyclohexyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzenesulfonate Openeye Name: cyclohexyl 4-(p-tolylsulfonylcarbamoylamino)benzenesulfonate CAS Name: 4-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]benzenesulfonic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzenesulfonate Traditional Name: 4-(tosylcarbamoylamino)benzenesulfonic acid cyclohexyl ester Formula: C20H24N2O6S2 MolecularWeight: 452.54436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)OC3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)OC3CCCCC3

InChI

InChI=1S/C20H24N2O6S2/c1-15-7-11-18(12-8-15)29(24,25)22-20(23)21-16-9-13-19(14-10-16)30(26,27)28-17-5-3-2-4-6-17/h7-14,17H,2-6H2,1H3,(H2,21,22,23)