4-[(2-fluorophenyl)methylsulfanyl]benzoic acid

Systemtic Name: 4-[(2-fluorophenyl)methylsulfanyl]benzoic acid Openeye Name: 4-[(2-fluorophenyl)methylsulfanyl]benzoic acid CAS Name: 4-[(2-fluorophenyl)methylthio]benzoic acid IUPAC Name: 4-[(2-fluorophenyl)methylsulfanyl]benzoic acid Traditional Name: 4-[(2-fluorobenzyl)thio]benzoic acid Formula: C14H11FO2S MolecularWeight: 262.299343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=CC=C(C=C2)C(=O)O)F

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=CC=C(C=C2)C(=O)O)F

InChI

InChI=1S/C14H11FO2S/c15-13-4-2-1-3-11(13)9-18-12-7-5-10(6-8-12)14(16)17/h1-8H,9H2,(H,16,17)