3-[6-[[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]methoxy]-1-benzofuran-2-yl]propanoic acid

Systemtic Name: 3-[6-[[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]methoxy]-1-benzofuran-2-yl]propanoic acid Openeye Name: 3-[6-[[4-phenyl-5-(trifluoromethyl)-2-thienyl]methoxy]benzofuran-2-yl]propanoic acid CAS Name: 3-[6-[[4-phenyl-5-(trifluoromethyl)-2-thiophenyl]methoxy]-2-benzofuranyl]propanoic acid IUPAC Name: 3-[6-[[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]methoxy]-1-benzofuran-2-yl]propanoic acid Traditional Name: 3-[6-[[4-phenyl-5-(trifluoromethyl)-2-thienyl]methoxy]benzofuran-2-yl]propionic acid Formula: C23H17F3O4S MolecularWeight: 446.43889

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(SC(=C2)COC3=CC4=C(C=C3)C=C(O4)CCC(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=C(SC(=C2)COC3=CC4=C(C=C3)C=C(O4)CCC(=O)O)C(F)(F)F

InChI

InChI=1S/C23H17F3O4S/c24-23(25,26)22-19(14-4-2-1-3-5-14)12-18(31-22)13-29-16-7-6-15-10-17(8-9-21(27)28)30-20(15)11-16/h1-7,10-12H,8-9,13H2,(H,27,28)