17-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]carbonylamino]heptadecyl nitrate

Systemtic Name: 17-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]carbonylamino]heptadecyl nitrate Openeye Name: 17-[[6-(4-methylpiperazin-1-yl)pyridine-3-carbonyl]amino]heptadecyl nitrate CAS Name: nitric acid 17-[[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]-oxomethyl]amino]heptadecyl ester IUPAC Name: 17-[[6-(4-methylpiperazin-1-yl)pyridine-3-carbonyl]amino]heptadecyl nitrate Traditional Name: nitric acid 17-[[6-(4-methylpiperazino)nicotinoyl]amino]heptadecyl ester Formula: C28H49N5O4 MolecularWeight: 519.71976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H49N5O4/c1-31-20-22-32(23-21-31)27-18-17-26(25-30-27)28(34)29-19-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-24-37-33(35)36/h17-18,25H,2-16,19-24H2,1H3,(H,29,34)