Chem
J-GLOBAL ID：200907052256360977   Nikkaji number：J1.231.603H

2-[1,2-Bis(methoxycarbonyl)vinyl]-5-(4-fluorophenyl)-2H-pyrazole-3,4-dicarboxylic acid dimethyl ester

2-[1,2-ビス(メトキシカルボニル)ビニル]-5-(4-フルオロフェニル)-2H-ピラゾール-3,4-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： C19H17FN2O8
Molecular formula furigana： C19-H17-F-N2-O8
Molecular weight： 420.349
InChI： InChI=1S/C19H17FN2O8/c1-27-13(23)9-12(17(24)28-2)22-16(19(26)30-4)14(18(25)29-3)15(21-22)10-5-7-11(20)8-6-10/h5-9H,1-4H3
InChI key： TUYVUJATFGVBSY-UHFFFAOYSA-N
SMILES： COC(=O)C=C(C(=O)OC)n1nc(c(C(=O)OC)c1C(=O)OC)c1ccc(F)cc1
Systematic name  (4)：
  • 1-[1-(メトキシカルボニル)-3-オキソ-3-メトキシ-1-プロペニル]-3-(4-フルオロフェニル)-1H-ピラゾール-4,5-ジカルボン酸ジメチル
  • 2-[1,2-ビス(メトキシカルボニル)ビニル]-5-(4-フルオロフェニル)-2H-ピラゾール-3,4-ジカルボン酸ジメチル
  • 4,5-ジメチル 1-(1,4-ジメトキシ-1,4-ジオキソブタ-2-エン-2-イル)-3-(4-フルオロフェニル)-1H-ピラゾール-4,5-ジカルボキシラート
  • 4,5-dimethyl 1-(1,4-dimethoxy-1,4-dioxobut-2-en-2-yl)-3-(4-fluorophenyl)-1H-pyrazole-4,5-dicarboxylate
Other name (2)：
  • 1-[1-(Methoxycarbonyl)-3-oxo-3-methoxy-1-propenyl]-3-(4-fluorophenyl)-1H-pyrazole-4,5-dicarboxylic acid dimethyl ester
  • 2-[1,2-Bis(methoxycarbonyl)vinyl]-5-(4-fluorophenyl)-2H-pyrazole-3,4-dicarboxylic acid dimethyl ester
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