Chem
J-GLOBAL ID:200907018552218090   Nikkaji number:J1.496.842C

2,2′-[2,6-Dioxocyclohexane-1,1-diylbis[(E)-2-butene-4,1-diyl]]bis(2-methylmalonic acid dimethyl) ester

2,2′-[2,6-ジオキソシクロヘキサン-1,1-ジイルビス[(E)-2-ブテン-4,1-ジイル]]ビス(2-メチルマロン酸ジメチル)
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: C26H36O10
Molecular formula furigana: C26-H36-O10
Molecular weight: 508.564
InChI: InChI=1S/C26H36O10/c1-24(20(29)33-3,21(30)34-4)14-7-9-16-26(18(27)12-11-13-19(26)28)17-10-8-15-25(2,22(31)35-5)23(32)36-6/h7-10H,11-17H2,1-6H3/b9-7+,10-8+
InChI key: APYUMOAUXLOSPM-FIFLTTCUSA-N
SMILES: COC(=O)C(C)(C/C=C/CC1(C/C=C/CC(C)(C(=O)OC)C(=O)OC)C(=O)CCCC1=O)C(=O)OC
Systematic name  (3):
  • 2,2′-[2,6-ジオキソシクロヘキサン-1,1-ジイルビス[(E)-2-ブテン-4,1-ジイル]]ビス(2-メチルマロン酸ジメチル)
  • 1,3-ジメチル 2-[(2E)-4-{1-[(2E)-6-メトキシ-5-(メトキシカルボニル)-5-メチル-6-オキソヘキサ-2-エン-1-イル]-2,6-ジオキソシクロヘキシル}ブタ-2-エン-1-イル]-2-メチルプロパンジオアート
  • 1,3-dimethyl 2-[(2E)-4-{1-[(2E)-6-methoxy-5-(methoxycarbonyl)-5-methyl-6-oxohex-2-en-1-yl]-2,6-dioxocyclohexyl}but-2-en-1-yl]-2-methylpropanedioate
Other name (1):
  • 2,2′-[2,6-Dioxocyclohexane-1,1-diylbis[(E)-2-butene-4,1-diyl]]bis(2-methylmalonic acid dimethyl) ester
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