2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[(3R)-3-methylpiperidin-1-yl]ethanone

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[(3R)-3-methylpiperidin-1-yl]ethanone Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[(3R)-3-methyl-1-piperidyl]ethanone CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-[(3R)-3-methyl-1-piperidinyl]ethanone IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-1-[(3R)-3-methylpiperidin-1-yl]ethanone Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[(3R)-3-methylpiperidino]ethanone Formula: C13H20N4O3 MolecularWeight: 280.3229

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

Isomeric SMILES

C[C@@H]1CCCN(C1)C(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

InChI

InChI=1S/C13H20N4O3/c1-9-5-4-6-15(7-9)12(18)8-16-11(3)13(17(19)20)10(2)14-16/h9H,4-8H2,1-3H3/t9-/m1/s1