6-[4-(2-methylpropyl)piperazin-1-yl]-N-(17-oxidanylheptadecyl)pyridine-3-carboxamide

Systemtic Name: 6-[4-(2-methylpropyl)piperazin-1-yl]-N-(17-oxidanylheptadecyl)pyridine-3-carboxamide Openeye Name: N-(17-hydroxyheptadecyl)-6-(4-isobutylpiperazin-1-yl)pyridine-3-carboxamide CAS Name: N-(17-hydroxyheptadecyl)-6-[4-(2-methylpropyl)-1-piperazinyl]-3-pyridinecarboxamide IUPAC Name: N-(17-hydroxyheptadecyl)-6-[4-(2-methylpropyl)piperazin-1-yl]pyridine-3-carboxamide Traditional Name: N-(17-hydroxyheptadecyl)-6-(4-isobutylpiperazino)nicotinamide Formula: C31H56N4O2 MolecularWeight: 516.80194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H56N4O2/c1-28(2)27-34-21-23-35(24-22-34)30-19-18-29(26-33-30)31(37)32-20-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-25-36/h18-19,26,28,36H,3-17,20-25,27H2,1-2H3,(H,32,37)