N-[(2E)-3,7-dimethylocta-2,6-dienyl]-2-(3-methylpiperidin-1-yl)quinoline-4-carboxamide

Systemtic Name: N-[(2E)-3,7-dimethylocta-2,6-dienyl]-2-(3-methylpiperidin-1-yl)quinoline-4-carboxamide Openeye Name: N-[(2E)-3,7-dimethylocta-2,6-dienyl]-2-(3-methyl-1-piperidyl)quinoline-4-carboxamide CAS Name: N-[(2E)-3,7-dimethylocta-2,6-dienyl]-2-(3-methyl-1-piperidinyl)-4-quinolinecarboxamide IUPAC Name: N-[(2E)-3,7-dimethylocta-2,6-dienyl]-2-(3-methylpiperidin-1-yl)quinoline-4-carboxamide Traditional Name: N-[(2E)-3,7-dimethylocta-2,6-dienyl]-2-(3-methylpiperidino)cinchoninamide Formula: C26H35N3O MolecularWeight: 405.5756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC=C(C)CCC=C(C)C

Isomeric SMILES

CC1CCCN(C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C26H35N3O/c1-19(2)9-7-10-20(3)14-15-27-26(30)23-17-25(29-16-8-11-21(4)18-29)28-24-13-6-5-12-22(23)24/h5-6,9,12-14,17,21H,7-8,10-11,15-16,18H2,1-4H3,(H,27,30)/b20-14+