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

Systemtic Name: 5-fluoranyl-2-[(4-fluorophenyl)methylsulfanyl]benzoic acid Openeye Name: 5-fluoro-2-[(4-fluorophenyl)methylsulfanyl]benzoic acid CAS Name: 5-fluoro-2-[(4-fluorophenyl)methylthio]benzoic acid IUPAC Name: 5-fluoro-2-[(4-fluorophenyl)methylsulfanyl]benzoic acid Traditional Name: 5-fluoro-2-[(4-fluorobenzyl)thio]benzoic acid Formula: C14H10F2O2S MolecularWeight: 280.289806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=C(C=C(C=C2)F)C(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1CSC2=C(C=C(C=C2)F)C(=O)O)F

InChI

InChI=1S/C14H10F2O2S/c15-10-3-1-9(2-4-10)8-19-13-6-5-11(16)7-12(13)14(17)18/h1-7H,8H2,(H,17,18)