4-fluoranyl-3,5-bis(methylsulfanyl)benzoic acid

Systemtic Name: 4-fluoranyl-3,5-bis(methylsulfanyl)benzoic acid Openeye Name: 4-fluoro-3,5-bis(methylsulfanyl)benzoic acid CAS Name: 4-fluoro-3,5-bis(methylthio)benzoic acid IUPAC Name: 4-fluoro-3,5-bis(methylsulfanyl)benzoic acid Traditional Name: 4-fluoro-3,5-bis(methylthio)benzoic acid Formula: C9H9FO2S2 MolecularWeight: 232.294963

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=CC(=C1F)SC)C(=O)O

Isomeric SMILES

CSC1=CC(=CC(=C1F)SC)C(=O)O

InChI

InChI=1S/C9H9FO2S2/c1-13-6-3-5(9(11)12)4-7(14-2)8(6)10/h3-4H,1-2H3,(H,11,12)