Chem
J-GLOBAL ID：200907024058324511   Nikkaji number：J1.429.586K

2-(2-Bromo-4,5-dimethoxyphenethyl)isoquinolinium

2-(2-ブロモ-4,5-ジメトキシフェネチル)イソキノリニウム
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： C19H19Br[N+]O2
Molecular formula furigana： C19-H19-BR-N-O2
Molecular weight： 373.269
InChI： InChI=1S/C19H19BrNO2/c1-22-18-11-15(17(20)12-19(18)23-2)8-10-21-9-7-14-5-3-4-6-16(14)13-21/h3-7,9,11-13H,8,10H2,1-2H3/q+1
InChI key： LTIBUTFOJBPJJF-UHFFFAOYSA-N
SMILES： COc1cc(Br)c(CC[n+]2ccc3ccccc3c2)cc1OC
Systematic name  (3)：
  • 2-(2-ブロモ-4,5-ジメトキシフェネチル)イソキノリニウム
  • 2-[2-(2-ブロモ-4,5-ジメトキシフェニル)エチル]イソキノリン-2-イウム
  • 2-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]isoquinolin-2-ium
Other name (1)：
  • 2-(2-Bromo-4,5-dimethoxyphenethyl)isoquinolinium
Thsaurus map：
Thesaurus Map

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