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

Systemtic Name: 8-chloranyl-2-pyridin-3-yl-N-[3-(trifluoromethyl)phenyl]quinoline-4-carboxamide Openeye Name: 8-chloro-2-(3-pyridyl)-N-[3-(trifluoromethyl)phenyl]quinoline-4-carboxamide CAS Name: 8-chloro-2-(3-pyridinyl)-N-[3-(trifluoromethyl)phenyl]-4-quinolinecarboxamide IUPAC Name: 8-chloro-2-pyridin-3-yl-N-[3-(trifluoromethyl)phenyl]quinoline-4-carboxamide Traditional Name: 8-chloro-2-(3-pyridyl)-N-[3-(trifluoromethyl)phenyl]cinchoninamide Formula: C22H13ClF3N3O MolecularWeight: 427.80633

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC(=NC3=C2C=CC=C3Cl)C4=CN=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC(=NC3=C2C=CC=C3Cl)C4=CN=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H13ClF3N3O/c23-18-8-2-7-16-17(11-19(29-20(16)18)13-4-3-9-27-12-13)21(30)28-15-6-1-5-14(10-15)22(24,25)26/h1-12H,(H,28,30)