Chem
J-GLOBAL ID:200907046346011297   Nikkaji number:J848.993I

2-Oxo-3-[[(4-nitrophenyl)sulfonyl]oxy]butanoic acid ethyl ester

2-オキソ-3-[[(4-ニトロフェニル)スルホニル]オキシ]ブタン酸エチル
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: C12H13[N+]O7[O-]S
Molecular formula furigana: C12-H13-N-O8-S
Molecular weight: 331.300
InChI: InChI=1S/C12H13NO8S/c1-3-20-12(15)11(14)8(2)21-22(18,19)10-6-4-9(5-7-10)13(16)17/h4-8H,3H2,1-2H3
InChI key: SCUSOFROJNNUGR-UHFFFAOYSA-N
SMILES: CCOC(=O)C(=O)C(C)OS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
Systematic name  (3):
  • 2-オキソ-3-[[(4-ニトロフェニル)スルホニル]オキシ]ブタン酸エチル
  • エチル 3-[(4-ニトロベンゼンスルホニル)オキシ]-2-オキソブタノアート
  • ethyl 3-[(4-nitrobenzenesulfonyl)oxy]-2-oxobutanoate
Other name (1):
  • 2-Oxo-3-[[(4-nitrophenyl)sulfonyl]oxy]butanoic acid ethyl ester
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