Chem
J-GLOBAL ID：200907016168198780   Nikkaji number：J579.448J

(1R,4S)-Bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylic acid 2-benzyl 3-methyl ester

(1R,4S)-ビシクロ[2.2.1]ヘプタ-2,5-ジエン-2,3-ジカルボン酸2-ベンジル3-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： C17H16O4
Molecular formula furigana： C17-H16-O4
Molecular weight： 284.311
InChI： InChI=1S/C17H16O4/c1-20-16(18)14-12-7-8-13(9-12)15(14)17(19)21-10-11-5-3-2-4-6-11/h2-8,12-13H,9-10H2,1H3/t12-,13+/m1/s1
InChI key： OOMBKABVDKDNGB-OLZOCXBDSA-N
SMILES： COC(=O)C1=C([C@@H]2C[C@H]1C=C2)C(=O)OCc1ccccc1
Systematic name  (3)：
  • (1R,4S)-ビシクロ[2.2.1]ヘプタ-2,5-ジエン-2,3-ジカルボン酸2-ベンジル3-メチル
  • 2-ベンジル 3-メチル (1R,4S)-ビシクロ[2.2.1]ヘプタ-2,5-ジエン-2,3-ジカルボキシラート
  • 2-benzyl 3-methyl (1R,4S)-bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate
Other name (1)：
  • (1R,4S)-Bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylic acid 2-benzyl 3-methyl ester
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