Chem
J-GLOBAL ID：200907010898043822   Nikkaji number：J991.821C

2-[2-Methyl-3-[(E)-hydroxyimino]butyl]malonic acid dibenzyl ester

2-[2-メチル-3-[(E)-ヒドロキシイミノ]ブチル]マロン酸ジベンジル
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： C22H25NO5
Molecular formula furigana： C22-H25-N-O5
Molecular weight： 383.444
InChI： InChI=1S/C22H25NO5/c1-16(17(2)23-26)13-20(21(24)27-14-18-9-5-3-6-10-18)22(25)28-15-19-11-7-4-8-12-19/h3-12,16,20,26H,13-15H2,1-2H3/b23-17+
InChI key： DYVUYPSMMRZPLU-HAVVHWLPSA-N
SMILES： CC(CC(C(=O)OCc1ccccc1)C(=O)OCc1ccccc1)/C(=N/O)/C
Systematic name  (3)：
  • 2-[2-メチル-3-[(E)-ヒドロキシイミノ]ブチル]マロン酸ジベンジル
  • 1,3-ジベンジル 2-[(3E)-3-(ヒドロキシイミノ)-2-メチルブチル]プロパンジオアート
  • 1,3-dibenzyl 2-[(3E)-3-(hydroxyimino)-2-methylbutyl]propanedioate
Other name (1)：
  • 2-[2-Methyl-3-[(E)-hydroxyimino]butyl]malonic acid dibenzyl ester
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