[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-[(3-methylphenyl)sulfamoyl]benzoate

Systemtic Name: [2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-[(3-methylphenyl)sulfamoyl]benzoate Openeye Name: [2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl] 3-(m-tolylsulfamoyl)benzoate CAS Name: 3-[(3-methylphenyl)sulfamoyl]benzoic acid [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 3-[(3-methylphenyl)sulfamoyl]benzoate Traditional Name: 3-(m-tolylsulfamoyl)benzoic acid [2-[(4-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C23H21FN2O5S MolecularWeight: 456.486643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C23H21FN2O5S/c1-16-4-2-6-20(12-16)26-32(29,30)21-7-3-5-18(13-21)23(28)31-15-22(27)25-14-17-8-10-19(24)11-9-17/h2-13,26H,14-15H2,1H3,(H,25,27)