1-(4-methyl-3-nitro-pyrazol-1-yl)butan-2-one

Systemtic Name: 1-(4-methyl-3-nitro-pyrazol-1-yl)butan-2-one Openeye Name: 1-(4-methyl-3-nitro-pyrazol-1-yl)butan-2-one CAS Name: 1-(4-methyl-3-nitro-1-pyrazolyl)-2-butanone IUPAC Name: 1-(4-methyl-3-nitropyrazol-1-yl)butan-2-one Traditional Name: 1-(4-methyl-3-nitro-pyrazol-1-yl)butan-2-one Formula: C8H11N3O3 MolecularWeight: 197.19124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CN1C=C(C(=N1)[N+](=O)[O-])C

Isomeric SMILES

CCC(=O)CN1C=C(C(=N1)[N+](=O)[O-])C

InChI

InChI=1S/C8H11N3O3/c1-3-7(12)5-10-4-6(2)8(9-10)11(13)14/h4H,3,5H2,1-2H3