2-[1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-phenyl-oxane-4-carboxylic acid

Systemtic Name: 2-[1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-phenyl-oxane-4-carboxylic acid Openeye Name: 2-[1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-phenyl-tetrahydropyran-4-carboxylic acid CAS Name: 2-[1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-oxanecarboxylic acid IUPAC Name: 2-[1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-phenyloxane-4-carboxylic acid Traditional Name: 2-[1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-phenyl-tetrahydropyran-4-carboxylic acid Formula: C22H20F6O4 MolecularWeight: 462.382219

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)OC2C(C(CCO2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)OC2C(C(CCO2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C22H20F6O4/c1-12(14-9-15(21(23,24)25)11-16(10-14)22(26,27)28)32-20-18(13-5-3-2-4-6-13)17(19(29)30)7-8-31-20/h2-6,9-12,17-18,20H,7-8H2,1H3,(H,29,30)