2-[[2-[[3-(2-nitrooxyethylcarbamoyl)pyridin-2-yl]disulfanyl]pyridin-3-yl]carbonylamino]ethyl nitrate

Systemtic Name: 2-[[2-[[3-(2-nitrooxyethylcarbamoyl)pyridin-2-yl]disulfanyl]pyridin-3-yl]carbonylamino]ethyl nitrate Openeye Name: 2-[[2-[[3-(2-nitrooxyethylcarbamoyl)-2-pyridyl]disulfanyl]pyridine-3-carbonyl]amino]ethyl nitrate CAS Name: nitric acid 2-[[[2-[[3-[(2-nitrooxyethylamino)-oxomethyl]-2-pyridinyl]disulfanyl]-3-pyridinyl]-oxomethyl]amino]ethyl ester IUPAC Name: 2-[[2-[[3-(2-nitrooxyethylcarbamoyl)pyridin-2-yl]disulfanyl]pyridine-3-carbonyl]amino]ethyl nitrate Traditional Name: nitric acid 2-[[2-[[3-(2-nitrooxyethylcarbamoyl)-2-pyridyl]disulfanyl]nicotinoyl]amino]ethyl ester Formula: C16H16N6O8S2 MolecularWeight: 484.46364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SSC2=C(C=CC=N2)C(=O)NCCO[N+](=O)[O-])C(=O)NCCO[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)SSC2=C(C=CC=N2)C(=O)NCCO[N+](=O)[O-])C(=O)NCCO[N+](=O)[O-]

InChI

InChI=1S/C16H16N6O8S2/c23-13(17-7-9-29-21(25)26)11-3-1-5-19-15(11)31-32-16-12(4-2-6-20-16)14(24)18-8-10-30-22(27)28/h1-6H,7-10H2,(H,17,23)(H,18,24)