5-[3-[2-chloranyl-4-(trifluoromethyloxy)phenoxy]propoxy]-2-methyl-3H-1-benzofuran-2-carboxylic acid

Systemtic Name: 5-[3-[2-chloranyl-4-(trifluoromethyloxy)phenoxy]propoxy]-2-methyl-3H-1-benzofuran-2-carboxylic acid Openeye Name: 5-[3-[2-chloro-4-(trifluoromethoxy)phenoxy]propoxy]-2-methyl-3H-benzofuran-2-carboxylic acid CAS Name: 5-[3-[2-chloro-4-(trifluoromethoxy)phenoxy]propoxy]-2-methyl-3H-benzofuran-2-carboxylic acid IUPAC Name: 5-[3-[2-chloro-4-(trifluoromethoxy)phenoxy]propoxy]-2-methyl-3H-1-benzofuran-2-carboxylic acid Traditional Name: 5-[3-[2-chloro-4-(trifluoromethoxy)phenoxy]propoxy]-2-methyl-coumaran-2-carboxylic acid Formula: C20H18ClF3O6 MolecularWeight: 446.80153

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C=CC(=C2)OCCCOC3=C(C=C(C=C3)OC(F)(F)F)Cl)C(=O)O

Isomeric SMILES

CC1(CC2=C(O1)C=CC(=C2)OCCCOC3=C(C=C(C=C3)OC(F)(F)F)Cl)C(=O)O

InChI

InChI=1S/C20H18ClF3O6/c1-19(18(25)26)11-12-9-13(3-5-16(12)30-19)27-7-2-8-28-17-6-4-14(10-15(17)21)29-20(22,23)24/h3-6,9-10H,2,7-8,11H2,1H3,(H,25,26)