Chem
J-GLOBAL ID：201007011759604698   Nikkaji number：J2.804.889K

2-(tert-Butoxycarbonyl)-4-[(E)-2-phenylethenyl]-1H-pyrrole-3-propanoic acid allyl ester

2-(tert-ブトキシカルボニル)-4-[(E)-2-フェニルエテニル]-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： C23H27NO4
Molecular formula furigana： C23-H27-N-O4
Molecular weight： 381.472
InChI： InChI=1S/C23H27NO4/c1-5-15-27-20(25)14-13-19-18(12-11-17-9-7-6-8-10-17)16-24-21(19)22(26)28-23(2,3)4/h5-12,16,24H,1,13-15H2,2-4H3/b12-11+
InChI key： DADCGWPXXYAZGO-VAWYXSNFSA-N
SMILES： CC(C)(C)OC(=O)c1[nH]cc(/C=C/c2ccccc2)c1CCC(=O)OCC=C
Systematic name  (3)：
  • 2-(tert-ブトキシカルボニル)-4-[(E)-2-フェニルエテニル]-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-[(1E)-2-フェニルエテニル]-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-[(1E)-2-phenylethenyl]-1H-pyrrole-2-carboxylate
Other name (1)：
  • 2-(tert-Butoxycarbonyl)-4-[(E)-2-phenylethenyl]-1H-pyrrole-3-propanoic acid allyl ester
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