3-(3-fluoranyl-4-methylsulfonyl-phenoxy)-5-oxidanyl-benzoic acid

Systemtic Name: 3-(3-fluoranyl-4-methylsulfonyl-phenoxy)-5-oxidanyl-benzoic acid Openeye Name: 3-(3-fluoro-4-methylsulfonyl-phenoxy)-5-hydroxy-benzoic acid CAS Name: 3-(3-fluoro-4-methylsulfonylphenoxy)-5-hydroxybenzoic acid IUPAC Name: 3-(3-fluoro-4-methylsulfonylphenoxy)-5-hydroxybenzoic acid Traditional Name: 3-(3-fluoro-4-mesyl-phenoxy)-5-hydroxy-benzoic acid Formula: C14H11FO6S MolecularWeight: 326.296943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)OC2=CC(=CC(=C2)O)C(=O)O)F

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)OC2=CC(=CC(=C2)O)C(=O)O)F

InChI

InChI=1S/C14H11FO6S/c1-22(19,20)13-3-2-10(7-12(13)15)21-11-5-8(14(17)18)4-9(16)6-11/h2-7,16H,1H3,(H,17,18)