2-(4-bromophenyl)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide

Systemtic Name: 2-(4-bromophenyl)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide Openeye Name: 2-(4-bromophenyl)-N-(2-pyridylmethyl)quinoline-4-carboxamide CAS Name: 2-(4-bromophenyl)-N-(2-pyridinylmethyl)-4-quinolinecarboxamide IUPAC Name: 2-(4-bromophenyl)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide Traditional Name: 2-(4-bromophenyl)-N-(2-pyridylmethyl)cinchoninamide Formula: C22H16BrN3O MolecularWeight: 418.28594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Br)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Br)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C22H16BrN3O/c23-16-10-8-15(9-11-16)21-13-19(18-6-1-2-7-20(18)26-21)22(27)25-14-17-5-3-4-12-24-17/h1-13H,14H2,(H,25,27)