2-[4-[5-(trifluoromethyl)pyridin-2-yl]sulfanylphenoxy]propanoic acid

Systemtic Name: 2-[4-[5-(trifluoromethyl)pyridin-2-yl]sulfanylphenoxy]propanoic acid Openeye Name: 2-[4-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]phenoxy]propanoic acid CAS Name: 2-[4-[[5-(trifluoromethyl)-2-pyridinyl]thio]phenoxy]propanoic acid IUPAC Name: 2-[4-[5-(trifluoromethyl)pyridin-2-yl]sulfanylphenoxy]propanoic acid Traditional Name: 2-[4-[[5-(trifluoromethyl)-2-pyridyl]thio]phenoxy]propionic acid Formula: C15H12F3NO3S MolecularWeight: 343.32089

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=C(C=C1)SC2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C(=O)O)OC1=CC=C(C=C1)SC2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C15H12F3NO3S/c1-9(14(20)21)22-11-3-5-12(6-4-11)23-13-7-2-10(8-19-13)15(16,17)18/h2-9H,1H3,(H,20,21)