2-fluoranyl-5-(oxan-2-ylsulfanyl)benzoic acid

Systemtic Name: 2-fluoranyl-5-(oxan-2-ylsulfanyl)benzoic acid Openeye Name: 2-fluoro-5-tetrahydropyran-2-ylsulfanyl-benzoic acid CAS Name: 2-fluoro-5-(2-oxanylthio)benzoic acid IUPAC Name: 2-fluoro-5-(oxan-2-ylsulfanyl)benzoic acid Traditional Name: 2-fluoro-5-(tetrahydropyran-2-ylthio)benzoic acid Formula: C12H13FO3S MolecularWeight: 256.293223

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)SC2=CC(=C(C=C2)F)C(=O)O

Isomeric SMILES

C1CCOC(C1)SC2=CC(=C(C=C2)F)C(=O)O

InChI

InChI=1S/C12H13FO3S/c13-10-5-4-8(7-9(10)12(14)15)17-11-3-1-2-6-16-11/h4-5,7,11H,1-3,6H2,(H,14,15)