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

Systemtic Name: 4,4-dimethyl-2-[3-propan-2-yloxy-5-[4-(trifluoromethyl)phenyl]phenyl]pentanoic acid Openeye Name: 2-[3-isopropoxy-5-[4-(trifluoromethyl)phenyl]phenyl]-4,4-dimethyl-pentanoic acid CAS Name: 4,4-dimethyl-2-[3-propan-2-yloxy-5-[4-(trifluoromethyl)phenyl]phenyl]pentanoic acid IUPAC Name: 4,4-dimethyl-2-[3-propan-2-yloxy-5-[4-(trifluoromethyl)phenyl]phenyl]pentanoic acid Traditional Name: 2-[3-isopropoxy-5-[4-(trifluoromethyl)phenyl]phenyl]-4,4-dimethyl-valeric acid Formula: C23H27F3O3 MolecularWeight: 408.45389

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=CC(=C1)C(CC(C)(C)C)C(=O)O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C)OC1=CC(=CC(=C1)C(CC(C)(C)C)C(=O)O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C23H27F3O3/c1-14(2)29-19-11-16(15-6-8-18(9-7-15)23(24,25)26)10-17(12-19)20(21(27)28)13-22(3,4)5/h6-12,14,20H,13H2,1-5H3,(H,27,28)