Chem
J-GLOBAL ID：200907055749147155
Nikkaji number：J1.120.911D
4-[1-(Cyclohexylmethyl)-1H-indole-5-yl]benzoic acid
4-[1-(シクロヘキシルメチル)-1H-インドール-5-イル]安息香酸
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
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
Molecular formula： C22H23NO2
Molecular formula furigana： C22-H23-N-O2
Molecular weight： 333.431
InChI：
InChI=1S/C22H23NO2/c24-22(25)18-8-6-17(7-9-18)19-10-11-21-20(14-19)12-13-23(21)15-16-4-2-1-3-5-16/h6-14,16H,1-5,15H2,(H,24,25)
InChI key：
VZFSTROZBQKVSV-UHFFFAOYSA-N
SMILES：
OC(=O)c1ccc(cc1)c1ccc2n(CC3CCCCC3)ccc2c1
Systematic name (2)：
- 4-[1-(シクロヘキシルメチル)-1H-インドール-5-イル]安息香酸
- 4-[1-(cyclohexylmethyl)-1H-indol-5-yl]benzoic acid
- 4-[1-(Cyclohexylmethyl)-1H-indole-5-yl]benzoic acid
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