methyl 1-[2-(4-nitropyrazol-1-yl)ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(4-nitropyrazol-1-yl)ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(4-nitropyrazol-1-yl)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(4-nitro-1-pyrazolyl)-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(4-nitropyrazol-1-yl)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(4-nitropyrazol-1-yl)acetyl]isonipecotic acid methyl ester Formula: C12H16N4O5 MolecularWeight: 296.27924

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CN2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CN2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O5/c1-21-12(18)9-2-4-14(5-3-9)11(17)8-15-7-10(6-13-15)16(19)20/h6-7,9H,2-5,8H2,1H3