1-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]piperidin-4-one

Systemtic Name: 1-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]piperidin-4-one Openeye Name: 1-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]piperidin-4-one CAS Name: 1-[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]-4-piperidinone IUPAC Name: 1-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]piperidin-4-one Traditional Name: 1-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]-4-piperidone Formula: C12H16N4O4 MolecularWeight: 280.27984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N2CCC(=O)CC2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N2CCC(=O)CC2)C)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O4/c1-8-12(16(19)20)9(2)15(13-8)7-11(18)14-5-3-10(17)4-6-14/h3-7H2,1-2H3