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

Systemtic Name: 3-fluoranyl-5-[(2-fluorophenyl)methylsulfanyl]benzoic acid Openeye Name: 3-fluoro-5-[(2-fluorophenyl)methylsulfanyl]benzoic acid CAS Name: 3-fluoro-5-[(2-fluorophenyl)methylthio]benzoic acid IUPAC Name: 3-fluoro-5-[(2-fluorophenyl)methylsulfanyl]benzoic acid Traditional Name: 3-fluoro-5-[(2-fluorobenzyl)thio]benzoic acid Formula: C14H10F2O2S MolecularWeight: 280.289806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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