Chem
J-GLOBAL ID：200907004781082312   Nikkaji number：J430.874C

2-[4-[Cyano(1-methylpyridinium-2-yl)methylene]-2,5-cyclohexadien-1-ylidene]-2-(1-methylpyridinium-6-yl)acetonitrile

2-[4-[シアノ(1-メチルピリジニウム-2-イル)メチレン]-2,5-シクロヘキサジエン-1-イリデン]-2-(1-メチルピリジニウム-6-イル)アセトニトリル
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： C22H18N2[N+]2
Molecular formula furigana： C22-H18-N4
Molecular weight： 338.413
InChI： InChI=1S/C22H18N4/c1-25-13-5-3-7-21(25)19(15-23)17-9-11-18(12-10-17)20(16-24)22-8-4-6-14-26(22)2/h3-14H,1-2H3/q+2/b19-17-,20-18+
InChI key： XTCCONVVRKJLGD-YAFCTCPESA-N
SMILES： C[n+]1ccccc1/C(=c\1/cc/c(=C(/C#N)\c2cccc[n+]2C)/cc1)/C#N
Systematic name  (3)：
  • 2-[4-[シアノ(1-メチルピリジニウム-2-イル)メチレン]-2,5-シクロヘキサジエン-1-イリデン]-2-(1-メチルピリジニウム-6-イル)アセトニトリル
  • 2-{シアノ[(1E,4E)-4-[シアノ(1-メチルピリジン-1-イウム-2-イル)メチリデン]シクロヘキサ-2,5-ジエン-1-イリデン]メチル}-1-メチルピリジン-1-イウム
  • 2-{cyano[(1E,4E)-4-[cyano(1-methylpyridin-1-ium-2-yl)methylidene]cyclohexa-2,5-dien-1-ylidene]methyl}-1-methylpyridin-1-ium
Other name (1)：
  • 2-[4-[Cyano(1-methylpyridinium-2-yl)methylene]-2,5-cyclohexadien-1-ylidene]-2-(1-methylpyridinium-6-yl)acetonitrile
Thsaurus map：
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