Chem
J-GLOBAL ID：200907066562350650   Nikkaji number：J1.120.910F

4-[1-(1-Propylbutyl)-1H-indole-5-yl]benzoic acid

4-[1-(ヘプタン-4-イル)-1H-インドール-5-イル]安息香酸
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： C22H25NO2
Molecular formula furigana： C22-H25-N-O2
Molecular weight： 335.447
InChI： InChI=1S/C22H25NO2/c1-3-5-20(6-4-2)23-14-13-19-15-18(11-12-21(19)23)16-7-9-17(10-8-16)22(24)25/h7-15,20H,3-6H2,1-2H3,(H,24,25)
InChI key： USRLFOQTYRSJLQ-UHFFFAOYSA-N
SMILES： CCCC(CCC)n1ccc2cc(ccc12)c1ccc(cc1)C(=O)O
Systematic name  (3)：
  • 4-[1-(1-プロピルブチル)-1H-インドール-5-イル]安息香酸
  • 4-[1-(ヘプタン-4-イル)-1H-インドール-5-イル]安息香酸
  • 4-[1-(heptan-4-yl)-1H-indol-5-yl]benzoic acid
Other name (1)：
  • 4-[1-(1-Propylbutyl)-1H-indole-5-yl]benzoic acid
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