[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-2-fluoranyl-benzoate

Systemtic Name: [2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-2-fluoranyl-benzoate Openeye Name: [2-(3-methylsulfonylanilino)-2-oxo-ethyl] 4-chloro-2-fluoro-benzoate CAS Name: 4-chloro-2-fluorobenzoic acid [2-(3-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylsulfonylanilino)-2-oxoethyl] 4-chloro-2-fluorobenzoate Traditional Name: 4-chloro-2-fluoro-benzoic acid [2-keto-2-(3-mesylanilino)ethyl] ester Formula: C16H13ClFNO5S MolecularWeight: 385.794523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)COC(=O)C2=C(C=C(C=C2)Cl)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)COC(=O)C2=C(C=C(C=C2)Cl)F

InChI

InChI=1S/C16H13ClFNO5S/c1-25(22,23)12-4-2-3-11(8-12)19-15(20)9-24-16(21)13-6-5-10(17)7-14(13)18/h2-8H,9H2,1H3,(H,19,20)