5,8-dimethyl-2-[4-(trifluoromethyl)phenyl]quinoline-4-carboxylic acid

Systemtic Name: 5,8-dimethyl-2-[4-(trifluoromethyl)phenyl]quinoline-4-carboxylic acid Openeye Name: 5,8-dimethyl-2-[4-(trifluoromethyl)phenyl]quinoline-4-carboxylic acid CAS Name: 5,8-dimethyl-2-[4-(trifluoromethyl)phenyl]-4-quinolinecarboxylic acid IUPAC Name: 5,8-dimethyl-2-[4-(trifluoromethyl)phenyl]quinoline-4-carboxylic acid Traditional Name: 5,8-dimethyl-2-[4-(trifluoromethyl)phenyl]cinchoninic acid Formula: C19H14F3NO2 MolecularWeight: 345.31517

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=NC2=C(C=C1)C)C3=CC=C(C=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=NC2=C(C=C1)C)C3=CC=C(C=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C19H14F3NO2/c1-10-3-4-11(2)17-16(10)14(18(24)25)9-15(23-17)12-5-7-13(8-6-12)19(20,21)22/h3-9H,1-2H3,(H,24,25)