2-methyl-2-[4-[4,4,4-tris(fluoranyl)-1-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]butyl]sulfanylphenoxy]propanoic acid

Systemtic Name: 2-methyl-2-[4-[4,4,4-tris(fluoranyl)-1-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]butyl]sulfanylphenoxy]propanoic acid Openeye Name: 2-methyl-2-[4-[4,4,4-trifluoro-1-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]butyl]sulfanylphenoxy]propanoic acid CAS Name: 2-methyl-2-[4-[[4,4,4-trifluoro-1-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]butyl]thio]phenoxy]propanoic acid IUPAC Name: 2-methyl-2-[4-[4,4,4-trifluoro-1-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]butyl]sulfanylphenoxy]propanoic acid Traditional Name: 2-methyl-2-[4-[[4,4,4-trifluoro-1-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]butyl]thio]phenoxy]propionic acid Formula: C23H20F6N2O4S MolecularWeight: 534.471319

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)SC(CCC(F)(F)F)C2=NN=C(O2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)SC(CCC(F)(F)F)C2=NN=C(O2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C23H20F6N2O4S/c1-21(2,20(32)33)35-15-7-9-16(10-8-15)36-17(11-12-22(24,25)26)19-31-30-18(34-19)13-3-5-14(6-4-13)23(27,28)29/h3-10,17H,11-12H2,1-2H3,(H,32,33)