tert-butyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzenesulfonate

Systemtic Name: tert-butyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzenesulfonate Openeye Name: tert-butyl 3-(p-tolylsulfonylcarbamoylamino)benzenesulfonate CAS Name: 3-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]benzenesulfonic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzenesulfonate Traditional Name: 3-(tosylcarbamoylamino)benzenesulfonic acid tert-butyl ester Formula: C18H22N2O6S2 MolecularWeight: 426.50708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O6S2/c1-13-8-10-15(11-9-13)27(22,23)20-17(21)19-14-6-5-7-16(12-14)28(24,25)26-18(2,3)4/h5-12H,1-4H3,(H2,19,20,21)