2-pyridin-4-yl-N-[[3-(trifluoromethyl)phenyl]methyl]quinoline-4-carboxamide

Systemtic Name: 2-pyridin-4-yl-N-[[3-(trifluoromethyl)phenyl]methyl]quinoline-4-carboxamide Openeye Name: 2-(4-pyridyl)-N-[[3-(trifluoromethyl)phenyl]methyl]quinoline-4-carboxamide CAS Name: 2-pyridin-4-yl-N-[[3-(trifluoromethyl)phenyl]methyl]-4-quinolinecarboxamide IUPAC Name: 2-pyridin-4-yl-N-[[3-(trifluoromethyl)phenyl]methyl]quinoline-4-carboxamide Traditional Name: 2-(4-pyridyl)-N-[3-(trifluoromethyl)benzyl]cinchoninamide Formula: C23H16F3N3O MolecularWeight: 407.38785

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)NCC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)NCC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C23H16F3N3O/c24-23(25,26)17-5-3-4-15(12-17)14-28-22(30)19-13-21(16-8-10-27-11-9-16)29-20-7-2-1-6-18(19)20/h1-13H,14H2,(H,28,30)