Chem
J-GLOBAL ID：200907001477666570   Nikkaji number：J1.825.669J

1-[3-(Furan-2-yl)-4-nitrobutanoyl]-3,5-dimethyl-1H-pyrazole

1-[3-(フラン-2-イル)-4-ニトロブタノイル]-3,5-ジメチル-1H-ピラゾール
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C13H15N2[N+]O3[O-]
Molecular formula furigana： C13-H15-N3-O4
Molecular weight： 277.280
InChI： InChI=1S/C13H15N3O4/c1-9-6-10(2)16(14-9)13(17)7-11(8-15(18)19)12-4-3-5-20-12/h3-6,11H,7-8H2,1-2H3
InChI key： ONJXMIVLEIWHIN-UHFFFAOYSA-N
SMILES： Cc1cc(C)n(n1)C(=O)CC(C[N+](=O)[O-])c1ccco1
Systematic name  (3)：
  • 1-[3-(フラン-2-イル)-4-ニトロブタノイル]-3,5-ジメチル-1H-ピラゾール
  • 1-(3,5-ジメチル-1H-ピラゾール-1-イル)-3-(フラン-2-イル)-4-ニトロブタン-1-オン
  • 1-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(furan-2-yl)-4-nitrobutan-1-one
Other name (1)：
  • 1-[3-(Furan-2-yl)-4-nitrobutanoyl]-3,5-dimethyl-1H-pyrazole
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