2-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]carbonylamino]ethyl nitrate dihydrochloride

Systemtic Name: 2-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]carbonylamino]ethyl nitrate dihydrochloride Openeye Name: 2-[[6-(4-methylpiperazin-1-yl)pyridine-3-carbonyl]amino]ethyl nitrate dihydrochloride CAS Name: nitric acid 2-[[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]-oxomethyl]amino]ethyl ester dihydrochloride IUPAC Name: 2-[[6-(4-methylpiperazin-1-yl)pyridine-3-carbonyl]amino]ethyl nitrate dihydrochloride Traditional Name: nitric acid 2-[[6-(4-methylpiperazino)nicotinoyl]amino]ethyl ester dihydrochloride Formula: C13H21Cl2N5O4 MolecularWeight: 382.24294

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCO[N+](=O)[O-].Cl.Cl

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C=C2)C(=O)NCCO[N+](=O)[O-].Cl.Cl

InChI

InChI=1S/C13H19N5O4.2ClH/c1-16-5-7-17(8-6-16)12-3-2-11(10-15-12)13(19)14-4-9-22-18(20)21;;/h2-3,10H,4-9H2,1H3,(H,14,19);2*1H