4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-4-oxo-butanoic acid CAS Name: 4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-4-oxobutanoic acid IUPAC Name: 4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-4-oxobutanoic acid Traditional Name: 4-(4-fluorophenyl)-4-keto-3-(4-mesylphenyl)butyric acid Formula: C17H15FO5S MolecularWeight: 350.361403

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(CC(=O)O)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(CC(=O)O)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H15FO5S/c1-24(22,23)14-8-4-11(5-9-14)15(10-16(19)20)17(21)12-2-6-13(18)7-3-12/h2-9,15H,10H2,1H3,(H,19,20)