12-[[6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-yl]carbonylamino]dodecyl nitrate

Systemtic Name: 12-[[6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-yl]carbonylamino]dodecyl nitrate Openeye Name: 12-[[6-(4-isopropylpiperazin-1-yl)pyridine-3-carbonyl]amino]dodecyl nitrate CAS Name: nitric acid 12-[[oxo-[6-(4-propan-2-yl-1-piperazinyl)-3-pyridinyl]methyl]amino]dodecyl ester IUPAC Name: 12-[[6-(4-propan-2-ylpiperazin-1-yl)pyridine-3-carbonyl]amino]dodecyl nitrate Traditional Name: nitric acid 12-[[6-(4-isopropylpiperazino)nicotinoyl]amino]dodecyl ester Formula: C25H43N5O4 MolecularWeight: 477.64002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H43N5O4/c1-22(2)28-16-18-29(19-17-28)24-14-13-23(21-27-24)25(31)26-15-11-9-7-5-3-4-6-8-10-12-20-34-30(32)33/h13-14,21-22H,3-12,15-20H2,1-2H3,(H,26,31)