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

Systemtic Name: 2-[3-aminocarbonyl-2-(4-methylpiperazin-1-yl)pyridin-4-yl]ethyl nitrate dihydrochloride Openeye Name: 2-[3-carbamoyl-2-(4-methylpiperazin-1-yl)-4-pyridyl]ethyl nitrate dihydrochloride CAS Name: nitric acid 2-[3-carbamoyl-2-(4-methyl-1-piperazinyl)-4-pyridinyl]ethyl ester dihydrochloride IUPAC Name: 2-[3-carbamoyl-2-(4-methylpiperazin-1-yl)pyridin-4-yl]ethyl nitrate dihydrochloride Traditional Name: nitric acid 2-[3-carbamoyl-2-(4-methylpiperazino)-4-pyridyl]ethyl ester dihydrochloride Formula: C13H21Cl2N5O4 MolecularWeight: 382.24294

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=CC(=C2C(=O)N)CCO[N+](=O)[O-].Cl.Cl

Isomeric SMILES

CN1CCN(CC1)C2=NC=CC(=C2C(=O)N)CCO[N+](=O)[O-].Cl.Cl

InChI

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