methyl 6-[2-(6-nitrohexanoyl)pyrazolidin-1-yl]carbonylpyridine-3-carboxylate

Systemtic Name: methyl 6-[2-(6-nitrohexanoyl)pyrazolidin-1-yl]carbonylpyridine-3-carboxylate Openeye Name: methyl 6-[2-(6-nitrohexanoyl)pyrazolidine-1-carbonyl]pyridine-3-carboxylate CAS Name: 6-[[2-(6-nitro-1-oxohexyl)-1-pyrazolidinyl]-oxomethyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[2-(6-nitrohexanoyl)pyrazolidine-1-carbonyl]pyridine-3-carboxylate Traditional Name: 6-[2-(6-nitrohexanoyl)pyrazolidine-1-carbonyl]nicotinic acid methyl ester Formula: C17H22N4O6 MolecularWeight: 378.37978

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)C(=O)N2CCCN2C(=O)CCCCC[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)C(=O)N2CCCN2C(=O)CCCCC[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O6/c1-27-17(24)13-7-8-14(18-12-13)16(23)20-10-5-9-19(20)15(22)6-3-2-4-11-21(25)26/h7-8,12H,2-6,9-11H2,1H3