[4-[(2-methylphenyl)carbamoyl]phenyl] 2,5-dimethylbenzenesulfonate

Systemtic Name: [4-[(2-methylphenyl)carbamoyl]phenyl] 2,5-dimethylbenzenesulfonate Openeye Name: [4-(o-tolylcarbamoyl)phenyl] 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid [4-[(2-methylanilino)-oxomethyl]phenyl] ester IUPAC Name: [4-[(2-methylphenyl)carbamoyl]phenyl] 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid [4-(o-tolylcarbamoyl)phenyl] ester Formula: C22H21NO4S MolecularWeight: 395.47144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C22H21NO4S/c1-15-8-9-17(3)21(14-15)28(25,26)27-19-12-10-18(11-13-19)22(24)23-20-7-5-4-6-16(20)2/h4-14H,1-3H3,(H,23,24)