Chem
J-GLOBAL ID：200907049716946524   Nikkaji number：J1.198.345F

2-(tert-Butoxycarbamoyl)propanedioic acid 1-ethyl 3-allyl ester

2-(tert-ブトキシカルバモイル)プロパン二酸1-エチル3-アリル
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： C13H21NO6
Molecular formula furigana： C13-H21-N-O6
Molecular weight： 287.312
InChI： InChI=1S/C13H21NO6/c1-6-8-19-12(17)9(11(16)18-7-2)10(15)14-20-13(3,4)5/h6,9H,1,7-8H2,2-5H3,(H,14,15)
InChI key： SJDIBCKJLKBRSV-UHFFFAOYSA-N
SMILES： CCOC(=O)C(C(=O)NOC(C)(C)C)C(=O)OCC=C
Systematic name  (3)：
  • 2-(tert-ブトキシカルバモイル)プロパン二酸1-エチル3-アリル
  • 1-エチル 3-プロパ-2-エン-1-イル 2-[(tert-ブトキシ)カルバモイル]プロパンジオアート
  • 1-ethyl 3-prop-2-en-1-yl 2-[(tert-butoxy)carbamoyl]propanedioate
Other name (1)：
  • 2-(tert-Butoxycarbamoyl)propanedioic acid 1-ethyl 3-allyl ester
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