Chem
J-GLOBAL ID：200907002113187878   Nikkaji number：J2.526.075I

2-(3-Cyanobenzyl)-6-(2,4,6-trimethylphenoxy)pyridazine-3(2H)-one

2-(3-シアノベンジル)-6-(2,4,6-トリメチルフェノキシ)ピリダジン-3(2H)-オン
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： C21H19N3O2
Molecular formula furigana： C21-H19-N3-O2
Molecular weight： 345.402
InChI： InChI=1S/C21H19N3O2/c1-14-9-15(2)21(16(3)10-14)26-19-7-8-20(25)24(23-19)13-18-6-4-5-17(11-18)12-22/h4-11H,13H2,1-3H3
InChI key： MLHITDCWQGLFLB-UHFFFAOYSA-N
SMILES： Cc1cc(C)c(Oc2ccc(=O)n(Cc3cccc(c3)C#N)n2)c(C)c1
Systematic name  (3)：
  • 2-(3-シアノベンジル)-6-(2,4,6-トリメチルフェノキシ)ピリダジン-3(2H)-オン
  • 3-{[6-オキソ-3-(2,4,6-トリメチルフェノキシ)-1,6-ジヒドロピリダジン-1-イル]メチル}ベンゾニトリル
  • 3-{[6-oxo-3-(2,4,6-trimethylphenoxy)-1,6-dihydropyridazin-1-yl]methyl}benzonitrile
Other name (1)：
  • 2-(3-Cyanobenzyl)-6-(2,4,6-trimethylphenoxy)pyridazine-3(2H)-one
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