Chem
J-GLOBAL ID：200907010834883436   Nikkaji number：J1.022.413F

2-(tert-Butoxycarbonyl)-4-methyl-5-[3-(1-methoxyethyl)-4-methyl-5-oxo-3-pyrroline-2-ylidenemethyl]-1H-pyrrole-3-propionic acid allyl ester

2-(tert-ブトキシカルボニル)-4-メチル-5-[3-(1-メトキシエチル)-4-メチル-5-オキソ-3-ピロリン-2-イリデンメチル]-1H-ピロール-3-プロピオン酸アリル
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： C25H34N2O6
Molecular formula furigana： C25-H34-N2-O6
Molecular weight： 458.555
InChI： InChI=1S/C25H34N2O6/c1-9-12-32-20(28)11-10-17-14(2)18(26-22(17)24(30)33-25(5,6)7)13-19-21(16(4)31-8)15(3)23(29)27-19/h9,13,16,26H,1,10-12H2,2-8H3,(H,27,29)
InChI key： JDWYUEXZQSQGBG-UHFFFAOYSA-N
SMILES： COC(C)C1=C(C)C(=O)NC1=Cc1[nH]c(C(=O)OC(C)(C)C)c(CCC(=O)OCC=C)c1C
Systematic name  (4)：
  • 2-(tert-ブトキシカルボニル)-4-メチル-5-[3-(1-メトキシエチル)-4-メチル-5-オキソ-3-ピロリン-2-イリデンメチル]-1H-ピロール-3-プロピオン酸アリル
  • 5-[[3-メチル-4-(1-メトキシエチル)-2-オキソ-1H-ピロール-5(2H)-イリデン]メチル]-2-(tert-ブトキシカルボニル)-4-メチル-1H-ピロール-3-プロピオン酸アリル
  • tert-ブチル 5-{[3-(1-メトキシエチル)-4-メチル-5-オキソ-2,5-ジヒドロ-1H-ピロール-2-イリデン]メチル}-4-メチル-3-[3-オキソ-3-(プロパ-2-エン-1-イルオキシ)プロピル]-1H-ピロール-2-カルボキシラート
  • tert-butyl 5-{[3-(1-methoxyethyl)-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-4-methyl-3-[3-oxo-3-(prop-2-en-1-yloxy)propyl]-1H-pyrrole-2-carboxylate
Other name (2)：
  • 2-(tert-Butoxycarbonyl)-4-methyl-5-[3-(1-methoxyethyl)-4-methyl-5-oxo-3-pyrroline-2-ylidenemethyl]-1H-pyrrole-3-propionic acid allyl ester
  • 5-[[3-Methyl-4-(1-methoxyethyl)-2-oxo-1H-pyrrole-5(2H)-ylidene]methyl]-2-(tert-butoxycarbonyl)-4-methyl-1H-pyrrole-3-propionic acid allyl ester
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