3-fluoranyl-4-(sulfanylmethyl)benzoic acid

Systemtic Name: 3-fluoranyl-4-(sulfanylmethyl)benzoic acid Openeye Name: 3-fluoro-4-(sulfanylmethyl)benzoic acid CAS Name: 3-fluoro-4-(mercaptomethyl)benzoic acid IUPAC Name: 3-fluoro-4-(sulfanylmethyl)benzoic acid Traditional Name: 3-fluoro-4-(mercaptomethyl)benzoic acid Formula: C8H7FO2S MolecularWeight: 186.203383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)F)CS

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)F)CS

InChI

InChI=1S/C8H7FO2S/c9-7-3-5(8(10)11)1-2-6(7)4-12/h1-3,12H,4H2,(H,10,11)