N-(1-cyclohexylethyl)-2-phenyl-3-(pyridin-4-ylmethyl)quinoline-4-carboxamide

Systemtic Name: N-(1-cyclohexylethyl)-2-phenyl-3-(pyridin-4-ylmethyl)quinoline-4-carboxamide Openeye Name: N-(1-cyclohexylethyl)-2-phenyl-3-(4-pyridylmethyl)quinoline-4-carboxamide CAS Name: N-(1-cyclohexylethyl)-2-phenyl-3-(pyridin-4-ylmethyl)-4-quinolinecarboxamide IUPAC Name: N-(1-cyclohexylethyl)-2-phenyl-3-(pyridin-4-ylmethyl)quinoline-4-carboxamide Traditional Name: N-(1-cyclohexylethyl)-2-phenyl-3-(4-pyridylmethyl)cinchoninamide Formula: C30H31N3O MolecularWeight: 449.58664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)CC5=CC=NC=C5

Isomeric SMILES

CC(C1CCCCC1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)CC5=CC=NC=C5

InChI

InChI=1S/C30H31N3O/c1-21(23-10-4-2-5-11-23)32-30(34)28-25-14-8-9-15-27(25)33-29(24-12-6-3-7-13-24)26(28)20-22-16-18-31-19-17-22/h3,6-9,12-19,21,23H,2,4-5,10-11,20H2,1H3,(H,32,34)