3-fluoranyl-4-[(4-methoxyphenyl)methylsulfanyl]benzoic acid

Systemtic Name: 3-fluoranyl-4-[(4-methoxyphenyl)methylsulfanyl]benzoic acid Openeye Name: 3-fluoro-4-[(4-methoxyphenyl)methylsulfanyl]benzoic acid CAS Name: 3-fluoro-4-[(4-methoxyphenyl)methylthio]benzoic acid IUPAC Name: 3-fluoro-4-[(4-methoxyphenyl)methylsulfanyl]benzoic acid Traditional Name: 3-fluoro-4-(p-anisylthio)benzoic acid Formula: C15H13FO3S MolecularWeight: 292.325323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=C(C=C(C=C2)C(=O)O)F

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=C(C=C(C=C2)C(=O)O)F

InChI

InChI=1S/C15H13FO3S/c1-19-12-5-2-10(3-6-12)9-20-14-7-4-11(15(17)18)8-13(14)16/h2-8H,9H2,1H3,(H,17,18)