4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-piperidin-1-yl-butan-1-one

Systemtic Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-piperidin-1-yl-butan-1-one Openeye Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-(1-piperidyl)butan-1-one CAS Name: 4-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-(1-piperidinyl)-1-butanone IUPAC Name: 4-(3,5-dimethyl-4-nitropyrazol-1-yl)-1-piperidin-1-ylbutan-1-one Traditional Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-piperidino-butan-1-one Formula: C14H22N4O3 MolecularWeight: 294.34948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)N2CCCCC2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)N2CCCCC2)C)[N+](=O)[O-]

InChI

InChI=1S/C14H22N4O3/c1-11-14(18(20)21)12(2)17(15-11)10-6-7-13(19)16-8-4-3-5-9-16/h3-10H2,1-2H3