Chem
J-GLOBAL ID：200907022954915780   Nikkaji number：J674.471K

4-Octyloxybenzoic acid 4-[(E)-2-(4-pyridyl)ethenyl]phenyl ester

4-オクチルオキシ安息香酸4-[(E)-2-(4-ピリジル)エテニル]フェニル
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： C28H31NO3
Molecular formula furigana： C28-H31-N-O3
Molecular weight： 429.560
InChI： InChI=1S/C28H31NO3/c1-2-3-4-5-6-7-22-31-26-16-12-25(13-17-26)28(30)32-27-14-10-23(11-15-27)8-9-24-18-20-29-21-19-24/h8-21H,2-7,22H2,1H3/b9-8+
InChI key： KURYNEKQNZCFSP-CMDGGOBGSA-N
SMILES： CCCCCCCCOc1ccc(cc1)C(=O)Oc1ccc(/C=C/c2ccncc2)cc1
Systematic name  (3)：
  • 4-オクチルオキシ安息香酸4-[(E)-2-(4-ピリジル)エテニル]フェニル
  • 4-[(1E)-2-(ピリジン-4-イル)エテニル]フェニル 4-(オクチルオキシ)ベンゾアート
  • 4-[(1E)-2-(pyridin-4-yl)ethenyl]phenyl 4-(octyloxy)benzoate
Other name (1)：
  • 4-Octyloxybenzoic acid 4-[(E)-2-(4-pyridyl)ethenyl]phenyl ester
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