Chem
J-GLOBAL ID：200907063236207740   Nikkaji number：J2.146.121K

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

4,4′-[(1E,3E,5E)-1,3,5-ヘキサトリエン-1,6-ジイル]二(安息香酸ブチル)
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： C28H32O4
Molecular formula furigana： C28-H32-O4
Molecular weight： 432.560
InChI： InChI=1S/C28H32O4/c1-3-5-21-31-27(29)25-17-13-23(14-18-25)11-9-7-8-10-12-24-15-19-26(20-16-24)28(30)32-22-6-4-2/h7-20H,3-6,21-22H2,1-2H3/b8-7+,11-9+,12-10+
InChI key： XGPUGZXXSYZFBO-BGSVYHRFSA-N
SMILES： CCCCOC(=O)c1ccc(/C=C/C=C/C=C/c2ccc(cc2)C(=O)OCCCC)cc1
Systematic name  (4)：
  • 4,4′-[(1E,3E,5E)-1,3,5-ヘキサトリエン-1,6-ジイル]ビス(安息香酸ブチル)
  • 4,4′-[(1E,3E,5E)-1,3,5-ヘキサトリエン-1,6-ジイル]二(安息香酸ブチル)
  • ブチル 4-[(1E,3E,5E)-6-[4-(ブトキシカルボニル)フェニル]ヘキサ-1,3,5-トリエン-1-イル]ベンゾアート
  • butyl 4-[(1E,3E,5E)-6-[4-(butoxycarbonyl)phenyl]hexa-1,3,5-trien-1-yl]benzoate
Other name (2)：
  • 4,4′-[(1E,3E,5E)-1,3,5-Hexatriene-1,6-diyl]bis(benzoic acid butyl) ester
  • 4,4′-[(1E,3E,5E)-1,3,5-Hexatriene-1,6-diyl]di(benzoic acid butyl) ester
Thsaurus map：
Thesaurus Map

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