Chem
J-GLOBAL ID:200907087011765821   Nikkaji number:J579.457I

(R)-5-Methyl-2,4-cyclohexadiene-1β,2-dicarboxylic acid 1-methyl 2-benzyl ester

(R)-5-メチル-2,4-シクロヘキサジエン-1β,2-ジカルボン酸1-メチル2-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: C17H18O4
Molecular formula furigana: C17-H18-O4
Molecular weight: 286.327
InChI: InChI=1S/C17H18O4/c1-12-8-9-14(15(10-12)16(18)20-2)17(19)21-11-13-6-4-3-5-7-13/h3-9,15H,10-11H2,1-2H3/t15-/m1/s1
InChI key: YEFZHRVJQMBFEK-OAHLLOKOSA-N
SMILES: COC(=O)[C@@H]1CC(=CC=C1C(=O)OCc1ccccc1)C
Systematic name  (3):
  • (R)-5-メチル-2,4-シクロヘキサジエン-1β,2-ジカルボン酸1-メチル2-ベンジル
  • 2-ベンジル 1-メチル (1R)-5-メチルシクロヘキサ-2,4-ジエン-1,2-ジカルボキシラート
  • 2-benzyl 1-methyl (1R)-5-methylcyclohexa-2,4-diene-1,2-dicarboxylate
Other name (1):
  • (R)-5-Methyl-2,4-cyclohexadiene-1β,2-dicarboxylic acid 1-methyl 2-benzyl ester
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