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

Systemtic Name: [4-[(4-fluorophenyl)carbamoyl]phenyl] 2,5-dimethylbenzenesulfonate Openeye Name: [4-[(4-fluorophenyl)carbamoyl]phenyl] 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid [4-[(4-fluoroanilino)-oxomethyl]phenyl] ester IUPAC Name: [4-[(4-fluorophenyl)carbamoyl]phenyl] 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid [4-[(4-fluorophenyl)carbamoyl]phenyl] ester Formula: C21H18FNO4S MolecularWeight: 399.435323

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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=C(C=C3)F

Isomeric SMILES

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

InChI

InChI=1S/C21H18FNO4S/c1-14-3-4-15(2)20(13-14)28(25,26)27-19-11-5-16(6-12-19)21(24)23-18-9-7-17(22)8-10-18/h3-13H,1-2H3,(H,23,24)