18-[[6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-yl]carbonylamino]octadecyl nitrate

Systemtic Name: 18-[[6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-yl]carbonylamino]octadecyl nitrate Openeye Name: 18-[[6-(4-isopropylpiperazin-1-yl)pyridine-3-carbonyl]amino]octadecyl nitrate CAS Name: nitric acid 18-[[oxo-[6-(4-propan-2-yl-1-piperazinyl)-3-pyridinyl]methyl]amino]octadecyl ester IUPAC Name: 18-[[6-(4-propan-2-ylpiperazin-1-yl)pyridine-3-carbonyl]amino]octadecyl nitrate Traditional Name: nitric acid 18-[[6-(4-isopropylpiperazino)nicotinoyl]amino]octadecyl ester Formula: C31H55N5O4 MolecularWeight: 561.7995

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCCCCCCCCCCCCCCCCO[N+](=O)[O-]

Isomeric SMILES

CC(C)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCCCCCCCCCCCCCCCCCO[N+](=O)[O-]

InChI

InChI=1S/C31H55N5O4/c1-28(2)34-22-24-35(25-23-34)30-20-19-29(27-33-30)31(37)32-21-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-26-40-36(38)39/h19-20,27-28H,3-18,21-26H2,1-2H3,(H,32,37)