[2,6-dimethoxy-3-[(4-methylphenyl)sulfonylamino]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2,6-dimethoxy-3-[(4-methylphenyl)sulfonylamino]phenyl] 4-methylbenzenesulfonate Openeye Name: [2,6-dimethoxy-3-(p-tolylsulfonylamino)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2,6-dimethoxy-3-[(4-methylphenyl)sulfonylamino]phenyl] ester IUPAC Name: [2,6-dimethoxy-3-[(4-methylphenyl)sulfonylamino]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2,6-dimethoxy-3-(tosylamino)phenyl] ester Formula: C22H23NO7S2 MolecularWeight: 477.55052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=C(C=C2)OC)OS(=O)(=O)C3=CC=C(C=C3)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=C(C=C2)OC)OS(=O)(=O)C3=CC=C(C=C3)C)OC

InChI

InChI=1S/C22H23NO7S2/c1-15-5-9-17(10-6-15)31(24,25)23-19-13-14-20(28-3)22(21(19)29-4)30-32(26,27)18-11-7-16(2)8-12-18/h5-14,23H,1-4H3