Chem
J-GLOBAL ID：200907062269618596   Nikkaji number：J1.467.875A

6,6′-(Cyclobutadiene-1,2-diyl)bis(azulene-1,3-dicarboxylic acid diethyl) ester

6,6′-(シクロブタジエン-1,2-ジイル)ビス(アズレン-1,3-ジカルボン酸ジエチル)
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： C36H32O8
Molecular formula furigana： C36-H32-O8
Molecular weight： 592.644
InChI： InChI=1S/C36H32O8/c1-5-41-33(37)29-19-30(34(38)42-6-2)26-14-10-21(9-13-25(26)29)23-17-18-24(23)22-11-15-27-28(16-12-22)32(36(40)44-8-4)20-31(27)35(39)43-7-3/h9-20H,5-8H2,1-4H3
InChI key： VVZXDCIALANYTN-UHFFFAOYSA-N
SMILES： CCOC(=O)c1cc(C(=O)OCC)c2ccc(ccc12)C1=C(C=C1)c1ccc2c(cc(C(=O)OCC)c2cc1)C(=O)OCC
Systematic name  (3)：
  • 6,6′-(シクロブタジエン-1,2-ジイル)ビス(アズレン-1,3-ジカルボン酸ジエチル)
  • 1,3-ジエチル 6-{2-[1,3-ビス(エトキシカルボニル)アズレン-6-イル]シクロブタ-1,3-ジエン-1-イル}アズレン-1,3-ジカルボキシラート
  • 1,3-diethyl 6-{2-[1,3-bis(ethoxycarbonyl)azulen-6-yl]cyclobuta-1,3-dien-1-yl}azulene-1,3-dicarboxylate
Other name (1)：
  • 6,6′-(Cyclobutadiene-1,2-diyl)bis(azulene-1,3-dicarboxylic acid diethyl) ester
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