[2-methyl-5-[(2-methylphenyl)sulfonylamino]phenyl] 2-methylbenzenesulfonate

Systemtic Name: [2-methyl-5-[(2-methylphenyl)sulfonylamino]phenyl] 2-methylbenzenesulfonate Openeye Name: [2-methyl-5-(o-tolylsulfonylamino)phenyl] 2-methylbenzenesulfonate CAS Name: 2-methylbenzenesulfonic acid [2-methyl-5-[(2-methylphenyl)sulfonylamino]phenyl] ester IUPAC Name: [2-methyl-5-[(2-methylphenyl)sulfonylamino]phenyl] 2-methylbenzenesulfonate Traditional Name: 2-methylbenzenesulfonic acid [2-methyl-5-(o-tolylsulfonylamino)phenyl] ester Formula: C21H21NO5S2 MolecularWeight: 431.52514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC=C2C)OS(=O)(=O)C3=CC=CC=C3C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC=C2C)OS(=O)(=O)C3=CC=CC=C3C

InChI

InChI=1S/C21H21NO5S2/c1-15-12-13-18(22-28(23,24)20-10-6-4-8-16(20)2)14-19(15)27-29(25,26)21-11-7-5-9-17(21)3/h4-14,22H,1-3H3