[(2S)-1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 5-chloranyl-2-fluoranyl-benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 5-chloranyl-2-fluoranyl-benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(3-sulfamoylanilino)ethyl] 5-chloro-2-fluoro-benzoate CAS Name: 5-chloro-2-fluorobenzoic acid [(2S)-1-oxo-1-(3-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(3-sulfamoylanilino)propan-2-yl] 5-chloro-2-fluorobenzoate Traditional Name: 5-chloro-2-fluoro-benzoic acid [(1S)-2-keto-1-methyl-2-(3-sulfamoylanilino)ethyl] ester Formula: C16H14ClFN2O5S MolecularWeight: 400.809163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)OC(=O)C2=C(C=CC(=C2)Cl)F

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)OC(=O)C2=C(C=CC(=C2)Cl)F

InChI

InChI=1S/C16H14ClFN2O5S/c1-9(25-16(22)13-7-10(17)5-6-14(13)18)15(21)20-11-3-2-4-12(8-11)26(19,23)24/h2-9H,1H3,(H,20,21)(H2,19,23,24)/t9-/m0/s1