Chem
J-GLOBAL ID：200907049125434176   Nikkaji number：J1.022.414D

2-(tert-Butoxycarbonyl)-4-methyl-5-[3-(1-methoxyethyl)-4-methyl-5-oxo-2-pyrroline-2-ylmethyl]-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-2-ピロリン-2-イルメチル]-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： C25H36N2O6
Molecular formula furigana： C25-H36-N2-O6
Molecular weight： 460.571
InChI： InChI=1S/C25H36N2O6/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/h9,15-16,26H,1,10-13H2,2-8H3,(H,27,29)
InChI key： FCWZQCVAOJLVAW-UHFFFAOYSA-N
SMILES： COC(C)C1=C(Cc2[nH]c(C(=O)OC(C)(C)C)c(CCC(=O)OCC=C)c2C)NC(=O)C1C
Systematic name  (3)：
  • 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-2-ピロリン-2-イルメチル]-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-4,5-ジヒドロ-1H-ピロール-2-イル]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-4,5-dihydro-1H-pyrrol-2-yl]methyl}-4-methyl-3-[3-oxo-3-(prop-2-en-1-yloxy)propyl]-1H-pyrrole-2-carboxylate
Other name (1)：
  • 2-(tert-Butoxycarbonyl)-4-methyl-5-[3-(1-methoxyethyl)-4-methyl-5-oxo-2-pyrroline-2-ylmethyl]-1H-pyrrole-3-propionic acid allyl ester
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