2-[4-(trifluoromethyl)pyridin-3-yl]sulfanylethanoic acid

Systemtic Name: 2-[4-(trifluoromethyl)pyridin-3-yl]sulfanylethanoic acid Openeye Name: 2-[[4-(trifluoromethyl)-3-pyridyl]sulfanyl]acetic acid CAS Name: 2-[[4-(trifluoromethyl)-3-pyridinyl]thio]acetic acid IUPAC Name: 2-[4-(trifluoromethyl)pyridin-3-yl]sulfanylacetic acid Traditional Name: 2-[[4-(trifluoromethyl)-3-pyridyl]thio]acetic acid Formula: C8H6F3NO2S MolecularWeight: 237.19895

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC(=C1C(F)(F)F)SCC(=O)O

Isomeric SMILES

C1=CN=CC(=C1C(F)(F)F)SCC(=O)O

InChI

InChI=1S/C8H6F3NO2S/c9-8(10,11)5-1-2-12-3-6(5)15-4-7(13)14/h1-3H,4H2,(H,13,14)