Chem
J-GLOBAL ID：200907026298178779   Nikkaji number：J2.267.318A

4,4′-[(1E,3E,5E)-1,3,5-Hexatriene-1,6-diyl]di(benzoic acid propyl) ester

4,4′-[(1E,3E,5E)-1,3,5-ヘキサトリエン-1,6-ジイル]二(安息香酸プロピル)
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： C26H28O4
Molecular formula furigana： C26-H28-O4
Molecular weight： 404.506
InChI： InChI=1S/C26H28O4/c1-3-19-29-25(27)23-15-11-21(12-16-23)9-7-5-6-8-10-22-13-17-24(18-14-22)26(28)30-20-4-2/h5-18H,3-4,19-20H2,1-2H3/b6-5+,9-7+,10-8+
InChI key： OUGNBKIJUMFQES-NRIIQWGUSA-N
SMILES： CCCOC(=O)c1ccc(/C=C/C=C/C=C/c2ccc(cc2)C(=O)OCCC)cc1
Systematic name  (3)：
  • 4,4′-[(1E,3E,5E)-1,3,5-ヘキサトリエン-1,6-ジイル]二(安息香酸プロピル)
  • プロピル 4-[(1E,3E,5E)-6-[4-(プロポキシカルボニル)フェニル]ヘキサ-1,3,5-トリエン-1-イル]ベンゾアート
  • propyl 4-[(1E,3E,5E)-6-[4-(propoxycarbonyl)phenyl]hexa-1,3,5-trien-1-yl]benzoate
Other name (1)：
  • 4,4′-[(1E,3E,5E)-1,3,5-Hexatriene-1,6-diyl]di(benzoic acid propyl) ester
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