2-(1-adamantyl)-N-[2-[2-(5-oxidanylpentylamino)ethylamino]quinolin-5-yl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[2-[2-(5-oxidanylpentylamino)ethylamino]quinolin-5-yl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[2-[2-(5-hydroxypentylamino)ethylamino]-5-quinolyl]acetamide CAS Name: 2-(1-adamantyl)-N-[2-[2-(5-hydroxypentylamino)ethylamino]-5-quinolinyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[2-[2-(5-hydroxypentylamino)ethylamino]quinolin-5-yl]acetamide Traditional Name: 2-(1-adamantyl)-N-[2-[2-(5-hydroxypentylamino)ethylamino]-5-quinolyl]acetamide Formula: C28H40N4O2 MolecularWeight: 464.6428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NC4=CC=CC5=C4C=CC(=N5)NCCNCCCCCO

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NC4=CC=CC5=C4C=CC(=N5)NCCNCCCCCO

InChI

InChI=1S/C28H40N4O2/c33-12-3-1-2-9-29-10-11-30-26-8-7-23-24(31-26)5-4-6-25(23)32-27(34)19-28-16-20-13-21(17-28)15-22(14-20)18-28/h4-8,20-22,29,33H,1-3,9-19H2,(H,30,31)(H,32,34)