2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylethanoic acid Openeye Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]acetic acid CAS Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]acetic acid IUPAC Name: 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanylacetic acid Traditional Name: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]acetic acid Formula: C8H5ClF3NO2S MolecularWeight: 271.64401

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC(=C1Cl)SCC(=O)O)C(F)(F)F

Isomeric SMILES

C1=C(C=NC(=C1Cl)SCC(=O)O)C(F)(F)F

InChI

InChI=1S/C8H5ClF3NO2S/c9-5-1-4(8(10,11)12)2-13-7(5)16-3-6(14)15/h1-2H,3H2,(H,14,15)