2,2-dimethyl-5-[4-[3-(trifluoromethyl)phenyl]carbonylphenoxy]pentanoic acid

Systemtic Name: 2,2-dimethyl-5-[4-[3-(trifluoromethyl)phenyl]carbonylphenoxy]pentanoic acid Openeye Name: 2,2-dimethyl-5-[4-[3-(trifluoromethyl)benzoyl]phenoxy]pentanoic acid CAS Name: 2,2-dimethyl-5-[4-[oxo-[3-(trifluoromethyl)phenyl]methyl]phenoxy]pentanoic acid IUPAC Name: 2,2-dimethyl-5-[4-[3-(trifluoromethyl)benzoyl]phenoxy]pentanoic acid Traditional Name: 2,2-dimethyl-5-[4-[3-(trifluoromethyl)benzoyl]phenoxy]valeric acid Formula: C21H21F3O4 MolecularWeight: 394.38425

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCOC1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

CC(C)(CCCOC1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C21H21F3O4/c1-20(2,19(26)27)11-4-12-28-17-9-7-14(8-10-17)18(25)15-5-3-6-16(13-15)21(22,23)24/h3,5-10,13H,4,11-12H2,1-2H3,(H,26,27)