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

Systemtic Name: (2-methylphenyl) 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzenesulfonate Openeye Name: o-tolyl 4-(p-tolylsulfonylcarbamoylamino)benzenesulfonate CAS Name: 4-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]benzenesulfonic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 4-[(4-methylphenyl)sulfonylcarbamoylamino]benzenesulfonate Traditional Name: 4-(tosylcarbamoylamino)benzenesulfonic acid o-tolyl ester Formula: C21H20N2O6S2 MolecularWeight: 460.5233

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)OC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)OC3=CC=CC=C3C

InChI

InChI=1S/C21H20N2O6S2/c1-15-7-11-18(12-8-15)30(25,26)23-21(24)22-17-9-13-19(14-10-17)31(27,28)29-20-6-4-3-5-16(20)2/h3-14H,1-2H3,(H2,22,23,24)