2-[5-methoxy-2-methyl-4-[[4-phenyl-6-(trifluoromethyl)pyridin-3-yl]methylsulfanyl]phenoxy]ethanoic acid

Systemtic Name: 2-[5-methoxy-2-methyl-4-[[4-phenyl-6-(trifluoromethyl)pyridin-3-yl]methylsulfanyl]phenoxy]ethanoic acid Openeye Name: 2-[5-methoxy-2-methyl-4-[[4-phenyl-6-(trifluoromethyl)-3-pyridyl]methylsulfanyl]phenoxy]acetic acid CAS Name: 2-[5-methoxy-2-methyl-4-[[4-phenyl-6-(trifluoromethyl)-3-pyridinyl]methylthio]phenoxy]acetic acid IUPAC Name: 2-[5-methoxy-2-methyl-4-[[4-phenyl-6-(trifluoromethyl)pyridin-3-yl]methylsulfanyl]phenoxy]acetic acid Traditional Name: 2-[5-methoxy-2-methyl-4-[[4-phenyl-6-(trifluoromethyl)-3-pyridyl]methylthio]phenoxy]acetic acid Formula: C23H20F3NO4S MolecularWeight: 463.46941

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OCC(=O)O)OC)SCC2=CN=C(C=C2C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1OCC(=O)O)OC)SCC2=CN=C(C=C2C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C23H20F3NO4S/c1-14-8-20(19(30-2)10-18(14)31-12-22(28)29)32-13-16-11-27-21(23(24,25)26)9-17(16)15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3,(H,28,29)