cyclohexyl 3-(2-methylphenyl)-2-(sulfonylcarbamoylamino)benzenesulfonate

Systemtic Name: cyclohexyl 3-(2-methylphenyl)-2-(sulfonylcarbamoylamino)benzenesulfonate Openeye Name: cyclohexyl 3-(o-tolyl)-2-(sulfonylcarbamoylamino)benzenesulfonate CAS Name: 3-(2-methylphenyl)-2-[[oxo-(sulfonylamino)methyl]amino]benzenesulfonic acid cyclohexyl ester IUPAC Name: cyclohexyl 3-(2-methylphenyl)-2-(sulfonylcarbamoylamino)benzenesulfonate Traditional Name: 3-(o-tolyl)-2-(sulfonylcarbamoylamino)benzenesulfonic acid cyclohexyl ester Formula: C20H22N2O6S2 MolecularWeight: 450.52848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C(=CC=C2)S(=O)(=O)OC3CCCCC3)NC(=O)N=S(=O)=O

Isomeric SMILES

CC1=CC=CC=C1C2=C(C(=CC=C2)S(=O)(=O)OC3CCCCC3)NC(=O)N=S(=O)=O

InChI

InChI=1S/C20H22N2O6S2/c1-14-8-5-6-11-16(14)17-12-7-13-18(19(17)21-20(23)22-29(24)25)30(26,27)28-15-9-3-2-4-10-15/h5-8,11-13,15H,2-4,9-10H2,1H3,(H,21,23)