Chem
J-GLOBAL ID：201207065904649112   Nikkaji number：J3.071.101G

3-(2,2-Dimethylpropyl)-4-benzoyl-3-cyclopentene-1,1-dicarboxylic acid dimethyl ester

3-ベンゾイル-4-(2,2-ジメチルプロピル)-3-シクロペンテン-1,1-ジカルボン酸ジメチル
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： C21H26O5
Molecular formula furigana： C21-H26-O5
Molecular weight： 358.434
InChI： InChI=1S/C21H26O5/c1-20(2,3)11-15-12-21(18(23)25-4,19(24)26-5)13-16(15)17(22)14-9-7-6-8-10-14/h6-10H,11-13H2,1-5H3
InChI key： YHLJQYPHEFQMLH-UHFFFAOYSA-N
SMILES： COC(=O)C1(CC(=C(C1)C(=O)c1ccccc1)CC(C)(C)C)C(=O)OC
Systematic name  (4)：
  • 3-(2,2-ジメチルプロピル)-4-ベンゾイル-3-シクロペンテン-1,1-ジカルボン酸ジメチル
  • 1,1-ジメチル 3-ベンゾイル-4-(2,2-ジメチルプロピル)シクロペンタ-3-エン-1,1-ジカルボキシラート
  • 1,1-dimethyl 3-benzoyl-4-(2,2-dimethylpropyl)cyclopent-3-ene-1,1-dicarboxylate
  • 3-ベンゾイル-4-(2,2-ジメチルプロピル)-3-シクロペンテン-1,1-ジカルボン酸ジメチル
Other name (1)：
  • 3-(2,2-Dimethylpropyl)-4-benzoyl-3-cyclopentene-1,1-dicarboxylic acid dimethyl ester
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