N-heptan-2-yl-2-(2-methylphenyl)quinoline-4-carboxamide

Systemtic Name: N-heptan-2-yl-2-(2-methylphenyl)quinoline-4-carboxamide Openeye Name: N-(1-methylhexyl)-2-(o-tolyl)quinoline-4-carboxamide CAS Name: N-heptan-2-yl-2-(2-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-heptan-2-yl-2-(2-methylphenyl)quinoline-4-carboxamide Traditional Name: N-(1-methylhexyl)-2-(o-tolyl)cinchoninamide Formula: C24H28N2O MolecularWeight: 360.49192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3C

Isomeric SMILES

CCCCCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3C

InChI

InChI=1S/C24H28N2O/c1-4-5-6-12-18(3)25-24(27)21-16-23(19-13-8-7-11-17(19)2)26-22-15-10-9-14-20(21)22/h7-11,13-16,18H,4-6,12H2,1-3H3,(H,25,27)