[4-(phenylcarbamoyl)phenyl] 2,5-dimethylbenzenesulfonate

Systemtic Name: [4-(phenylcarbamoyl)phenyl] 2,5-dimethylbenzenesulfonate Openeye Name: [4-(phenylcarbamoyl)phenyl] 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid [4-[anilino(oxo)methyl]phenyl] ester IUPAC Name: [4-(phenylcarbamoyl)phenyl] 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid [4-(phenylcarbamoyl)phenyl] ester Formula: C21H19NO4S MolecularWeight: 381.44486

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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=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H19NO4S/c1-15-8-9-16(2)20(14-15)27(24,25)26-19-12-10-17(11-13-19)21(23)22-18-6-4-3-5-7-18/h3-14H,1-2H3,(H,22,23)