3-methyl-2-[4-(trifluoromethyl)-1,3-dihydroisoindol-2-yl]butanoic acid

Systemtic Name: 3-methyl-2-[4-(trifluoromethyl)-1,3-dihydroisoindol-2-yl]butanoic acid Openeye Name: 3-methyl-2-[4-(trifluoromethyl)isoindolin-2-yl]butanoic acid CAS Name: 3-methyl-2-[4-(trifluoromethyl)-1,3-dihydroisoindol-2-yl]butanoic acid IUPAC Name: 3-methyl-2-[4-(trifluoromethyl)-1,3-dihydroisoindol-2-yl]butanoic acid Traditional Name: 3-methyl-2-[4-(trifluoromethyl)isoindolin-2-yl]butyric acid Formula: C14H16F3NO2 MolecularWeight: 287.27755

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N1CC2=C(C1)C(=CC=C2)C(F)(F)F

Isomeric SMILES

CC(C)C(C(=O)O)N1CC2=C(C1)C(=CC=C2)C(F)(F)F

InChI

InChI=1S/C14H16F3NO2/c1-8(2)12(13(19)20)18-6-9-4-3-5-11(10(9)7-18)14(15,16)17/h3-5,8,12H,6-7H2,1-2H3,(H,19,20)