[3-(trifluoromethyl)phenyl]methyl quinoline-2-carboxylate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl quinoline-2-carboxylate Openeye Name: [3-(trifluoromethyl)phenyl]methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl quinoline-2-carboxylate Traditional Name: quinaldic acid [3-(trifluoromethyl)benzyl] ester Formula: C18H12F3NO2 MolecularWeight: 331.28859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H12F3NO2/c19-18(20,21)14-6-3-4-12(10-14)11-24-17(23)16-9-8-13-5-1-2-7-15(13)22-16/h1-10H,11H2