3,3-dimethyl-2-[3-propoxy-5-[4-(trifluoromethyl)phenyl]phenyl]butanoic acid

Systemtic Name: 3,3-dimethyl-2-[3-propoxy-5-[4-(trifluoromethyl)phenyl]phenyl]butanoic acid Openeye Name: 3,3-dimethyl-2-[3-propoxy-5-[4-(trifluoromethyl)phenyl]phenyl]butanoic acid CAS Name: 3,3-dimethyl-2-[3-propoxy-5-[4-(trifluoromethyl)phenyl]phenyl]butanoic acid IUPAC Name: 3,3-dimethyl-2-[3-propoxy-5-[4-(trifluoromethyl)phenyl]phenyl]butanoic acid Traditional Name: 3,3-dimethyl-2-[3-propoxy-5-[4-(trifluoromethyl)phenyl]phenyl]butyric acid Formula: C22H25F3O3 MolecularWeight: 394.42731

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25F3O3/c1-5-10-28-18-12-15(14-6-8-17(9-7-14)22(23,24)25)11-16(13-18)19(20(26)27)21(2,3)4/h6-9,11-13,19H,5,10H2,1-4H3,(H,26,27)