Chem
J-GLOBAL ID：200907089163214386   Nikkaji number：J1.198.343J

2-(tert-Butoxycarbamoyl)propanedioic acid 1-methyl 3-benzyl ester

2-(tert-ブトキシカルバモイル)プロパン二酸1-メチル3-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： C16H21NO6
Molecular formula furigana： C16-H21-N-O6
Molecular weight： 323.345
InChI： InChI=1S/C16H21NO6/c1-16(2,3)23-17-13(18)12(14(19)21-4)15(20)22-10-11-8-6-5-7-9-11/h5-9,12H,10H2,1-4H3,(H,17,18)
InChI key： QANFYOCAAILLCI-UHFFFAOYSA-N
SMILES： COC(=O)C(C(=O)NOC(C)(C)C)C(=O)OCc1ccccc1
Systematic name  (3)：
  • 2-(tert-ブトキシカルバモイル)プロパン二酸1-メチル3-ベンジル
  • 1-ベンジル 3-メチル 2-[(tert-ブトキシ)カルバモイル]プロパンジオアート
  • 1-benzyl 3-methyl 2-[(tert-butoxy)carbamoyl]propanedioate
Other name (1)：
  • 2-(tert-Butoxycarbamoyl)propanedioic acid 1-methyl 3-benzyl ester
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