2-[[1-[(3-chloranyl-4-methoxy-phenyl)methyl]-5-nitro-2-oxidanylidene-pyridin-3-yl]carbonylamino]ethyl nitrate

Systemtic Name: 2-[[1-[(3-chloranyl-4-methoxy-phenyl)methyl]-5-nitro-2-oxidanylidene-pyridin-3-yl]carbonylamino]ethyl nitrate Openeye Name: 2-[[1-[(3-chloro-4-methoxy-phenyl)methyl]-5-nitro-2-oxo-pyridine-3-carbonyl]amino]ethyl nitrate CAS Name: nitric acid 2-[[[1-[(3-chloro-4-methoxyphenyl)methyl]-5-nitro-2-oxo-3-pyridinyl]-oxomethyl]amino]ethyl ester IUPAC Name: 2-[[1-[(3-chloro-4-methoxyphenyl)methyl]-5-nitro-2-oxopyridine-3-carbonyl]amino]ethyl nitrate Traditional Name: nitric acid 2-[[1-(3-chloro-4-methoxy-benzyl)-2-keto-5-nitro-nicotinoyl]amino]ethyl ester Formula: C16H15ClN4O8 MolecularWeight: 426.7653

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C=C(C=C(C2=O)C(=O)NCCO[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C=C(C=C(C2=O)C(=O)NCCO[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C16H15ClN4O8/c1-28-14-3-2-10(6-13(14)17)8-19-9-11(20(24)25)7-12(16(19)23)15(22)18-4-5-29-21(26)27/h2-3,6-7,9H,4-5,8H2,1H3,(H,18,22)