2-[[3-fluoranyl-1-(4-methylsulfonylphenyl)-1-oxidanyl-propan-2-yl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[3-fluoranyl-1-(4-methylsulfonylphenyl)-1-oxidanyl-propan-2-yl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[[1-(fluoromethyl)-2-hydroxy-2-(4-methylsulfonylphenyl)ethyl]amino]-2-oxo-acetic acid CAS Name: 2-[[3-fluoro-1-hydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]amino]-2-oxoacetic acid IUPAC Name: 2-[[3-fluoro-1-hydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]amino]-2-oxoacetic acid Traditional Name: 2-[[1-(fluoromethyl)-2-hydroxy-2-(4-mesylphenyl)ethyl]amino]-2-keto-acetic acid Formula: C12H14FNO6S MolecularWeight: 319.306063

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(C(CF)NC(=O)C(=O)O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(C(CF)NC(=O)C(=O)O)O

InChI

InChI=1S/C12H14FNO6S/c1-21(19,20)8-4-2-7(3-5-8)10(15)9(6-13)14-11(16)12(17)18/h2-5,9-10,15H,6H2,1H3,(H,14,16)(H,17,18)