14-[[6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-yl]carbonylamino]tetradecyl nitrate

Systemtic Name: 14-[[6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-yl]carbonylamino]tetradecyl nitrate Openeye Name: 14-[[6-(4-isopropylpiperazin-1-yl)pyridine-3-carbonyl]amino]tetradecyl nitrate CAS Name: nitric acid 14-[[oxo-[6-(4-propan-2-yl-1-piperazinyl)-3-pyridinyl]methyl]amino]tetradecyl ester IUPAC Name: 14-[[6-(4-propan-2-ylpiperazin-1-yl)pyridine-3-carbonyl]amino]tetradecyl nitrate Traditional Name: nitric acid 14-[[6-(4-isopropylpiperazino)nicotinoyl]amino]tetradecyl ester Formula: C27H47N5O4 MolecularWeight: 505.69318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H47N5O4/c1-24(2)30-18-20-31(21-19-30)26-16-15-25(23-29-26)27(33)28-17-13-11-9-7-5-3-4-6-8-10-12-14-22-36-32(34)35/h15-16,23-24H,3-14,17-22H2,1-2H3,(H,28,33)