6-[4-(2-methylpropyl)piperazin-1-yl]-N-(18-oxidanyloctadecyl)pyridine-3-carboxamide

Systemtic Name: 6-[4-(2-methylpropyl)piperazin-1-yl]-N-(18-oxidanyloctadecyl)pyridine-3-carboxamide Openeye Name: N-(18-hydroxyoctadecyl)-6-(4-isobutylpiperazin-1-yl)pyridine-3-carboxamide CAS Name: N-(18-hydroxyoctadecyl)-6-[4-(2-methylpropyl)-1-piperazinyl]-3-pyridinecarboxamide IUPAC Name: N-(18-hydroxyoctadecyl)-6-[4-(2-methylpropyl)piperazin-1-yl]pyridine-3-carboxamide Traditional Name: N-(18-hydroxyoctadecyl)-6-(4-isobutylpiperazino)nicotinamide Formula: C32H58N4O2 MolecularWeight: 530.82852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCCCCCCCCCCCCCCCCO

Isomeric SMILES

CC(C)CN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCCCCCCCCCCCCCCCCO

InChI

InChI=1S/C32H58N4O2/c1-29(2)28-35-22-24-36(25-23-35)31-20-19-30(27-34-31)32(38)33-21-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-26-37/h19-20,27,29,37H,3-18,21-26,28H2,1-2H3,(H,33,38)