Chem
J-GLOBAL ID：200907060053468406   Nikkaji number：J786.268G

4-Cyanobenzoic acid 2-(1-pyrenyl)ethyl ester

4-シアノ安息香酸2-(1-ピレニル)エチル
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： C26H17NO2
Molecular formula furigana： C26-H17-N-O2
Molecular weight： 375.427
InChI： InChI=1S/C26H17NO2/c27-16-17-4-6-22(7-5-17)26(28)29-15-14-18-8-9-21-11-10-19-2-1-3-20-12-13-23(18)25(21)24(19)20/h1-13H,14-15H2
InChI key： ZQPMRQGVUBZPOM-UHFFFAOYSA-N
SMILES： O=C(OCCc1ccc2ccc3cccc4ccc1c2c34)c1ccc(cc1)C#N
Systematic name  (3)：
  • 4-シアノ安息香酸2-(1-ピレニル)エチル
  • 2-(ピレン-1-イル)エチル 4-シアノベンゾアート
  • 2-(pyren-1-yl)ethyl 4-cyanobenzoate
Other name (1)：
  • 4-Cyanobenzoic acid 2-(1-pyrenyl)ethyl ester
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