[2-[(2-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 5-chloranyl-2-fluoranyl-benzoate

Systemtic Name: [2-[(2-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 5-chloranyl-2-fluoranyl-benzoate Openeye Name: [2-(2-methylsulfonylanilino)-2-oxo-ethyl] 5-chloro-2-fluoro-benzoate CAS Name: 5-chloro-2-fluorobenzoic acid [2-(2-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylsulfonylanilino)-2-oxoethyl] 5-chloro-2-fluorobenzoate Traditional Name: 5-chloro-2-fluoro-benzoic acid [2-keto-2-(2-mesylanilino)ethyl] ester Formula: C16H13ClFNO5S MolecularWeight: 385.794523

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1NC(=O)COC(=O)C2=C(C=CC(=C2)Cl)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1NC(=O)COC(=O)C2=C(C=CC(=C2)Cl)F

InChI

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