8-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]carbonylamino]octyl nitrate

Systemtic Name: 8-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]carbonylamino]octyl nitrate Openeye Name: 8-[[6-(4-methylpiperazin-1-yl)pyridine-3-carbonyl]amino]octyl nitrate CAS Name: nitric acid 8-[[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]-oxomethyl]amino]octyl ester IUPAC Name: 8-[[6-(4-methylpiperazin-1-yl)pyridine-3-carbonyl]amino]octyl nitrate Traditional Name: nitric acid 8-[[6-(4-methylpiperazino)nicotinoyl]amino]octyl ester Formula: C19H31N5O4 MolecularWeight: 393.48054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCCCCCCO[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCCCCCCO[N+](=O)[O-]

InChI

InChI=1S/C19H31N5O4/c1-22-11-13-23(14-12-22)18-9-8-17(16-21-18)19(25)20-10-6-4-2-3-5-7-15-28-24(26)27/h8-9,16H,2-7,10-15H2,1H3,(H,20,25)