Chem
J-GLOBAL ID：200907002583770731   Nikkaji number：J496.646E

4-[2-[2,3-Bis(methoxycarbonyl)-5-methylphenyl]ethenyl]-5-cyano-1H-pyrrole-1,3-dicarboxylic acid dimethyl ester

4-[2-[2,3-ビス(メトキシカルボニル)-5-メチルフェニル]エテニル]-5-シアノ-1H-ピロール-1,3-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： C22H20N2O8
Molecular formula furigana： C22-H20-N2-O8
Molecular weight： 440.408
InChI： InChI=1S/C22H20N2O8/c1-12-8-13(18(21(27)31-4)15(9-12)19(25)29-2)6-7-14-16(20(26)30-3)11-24(17(14)10-23)22(28)32-5/h6-9,11H,1-5H3
InChI key： QUTWLAQXESTFJV-UHFFFAOYSA-N
SMILES： COC(=O)c1cn(C(=O)OC)c(C#N)c1C=Cc1cc(C)cc(C(=O)OC)c1C(=O)OC
Systematic name  (3)：
  • 4-[2-[2,3-ビス(メトキシカルボニル)-5-メチルフェニル]エテニル]-5-シアノ-1H-ピロール-1,3-ジカルボン酸ジメチル
  • 1,3-ジメチル 4-{2-[2,3-ビス(メトキシカルボニル)-5-メチルフェニル]エテニル}-5-シアノ-1H-ピロール-1,3-ジカルボキシラート
  • 1,3-dimethyl 4-{2-[2,3-bis(methoxycarbonyl)-5-methylphenyl]ethenyl}-5-cyano-1H-pyrrole-1,3-dicarboxylate
Other name (1)：
  • 4-[2-[2,3-Bis(methoxycarbonyl)-5-methylphenyl]ethenyl]-5-cyano-1H-pyrrole-1,3-dicarboxylic acid dimethyl ester
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