Chem
J-GLOBAL ID：200907060736120677   Nikkaji number：J1.198.356A

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

2-(tert-ブトキシカルバモイル)-2-ベンジルプロパン二酸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： C23H27NO6
Molecular formula furigana： C23-H27-N-O6
Molecular weight： 413.470
InChI： InChI=1S/C23H27NO6/c1-22(2,3)30-24-19(25)23(20(26)28-4,15-17-11-7-5-8-12-17)21(27)29-16-18-13-9-6-10-14-18/h5-14H,15-16H2,1-4H3,(H,24,25)
InChI key： VZQYQXUPKVCYSB-UHFFFAOYSA-N
SMILES： COC(=O)C(Cc1ccccc1)(C(=O)NOC(C)(C)C)C(=O)OCc1ccccc1
Systematic name  (3)：
  • 2-(tert-ブトキシカルバモイル)-2-ベンジルプロパン二酸1-メチル3-ベンジル
  • 1-ベンジル 3-メチル 2-ベンジル-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-benzyl-2-[(tert-butoxy)carbamoyl]propanedioate
Other name (1)：
  • 2-(tert-Butoxycarbamoyl)-2-benzylpropanedioic acid 1-methyl 3-benzyl ester
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