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

Systemtic Name: [4-[(5-acetamido-2-methyl-phenyl)carbamoyl]phenyl] 2,5-dimethylbenzenesulfonate Openeye Name: [4-[(5-acetamido-2-methyl-phenyl)carbamoyl]phenyl] 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid [4-[(5-acetamido-2-methylanilino)-oxomethyl]phenyl] ester IUPAC Name: [4-[(5-acetamido-2-methylphenyl)carbamoyl]phenyl] 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid [4-[(5-acetamido-2-methyl-phenyl)carbamoyl]phenyl] ester Formula: C24H24N2O5S MolecularWeight: 452.52276

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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=C(C=CC(=C3)NC(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)NC(=O)C)C

InChI

InChI=1S/C24H24N2O5S/c1-15-5-6-17(3)23(13-15)32(29,30)31-21-11-8-19(9-12-21)24(28)26-22-14-20(25-18(4)27)10-7-16(22)2/h5-14H,1-4H3,(H,25,27)(H,26,28)