Chem
J-GLOBAL ID：201007045599467631   Nikkaji number：J2.804.895E

2-(tert-Butoxycarbonyl)-4-pentyl-1H-pyrrole-3-propanoic acid allyl ester

2-(tert-ブトキシカルボニル)-4-ペンチル-1H-ピロール-3-プロパン酸アリル
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： C20H31NO4
Molecular formula furigana： C20-H31-N-O4
Molecular weight： 349.471
InChI： InChI=1S/C20H31NO4/c1-6-8-9-10-15-14-21-18(19(23)25-20(3,4)5)16(15)11-12-17(22)24-13-7-2/h7,14,21H,2,6,8-13H2,1,3-5H3
InChI key： ZOIXABHEEGVOMZ-UHFFFAOYSA-N
SMILES： CCCCCc1c[nH]c(C(=O)OC(C)(C)C)c1CCC(=O)OCC=C
Systematic name  (3)：
  • 2-(tert-ブトキシカルボニル)-4-ペンチル-1H-ピロール-3-プロパン酸アリル
  • tert-ブチル 3-[3-オキソ-3-(プロパ-2-エン-1-イルオキシ)プロピル]-4-ペンチル-1H-ピロール-2-カルボキシラート
  • tert-butyl 3-[3-oxo-3-(prop-2-en-1-yloxy)propyl]-4-pentyl-1H-pyrrole-2-carboxylate
Other name (1)：
  • 2-(tert-Butoxycarbonyl)-4-pentyl-1H-pyrrole-3-propanoic acid allyl ester
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