Chem
J-GLOBAL ID:200907035601856040   Nikkaji number:J2.215.308K

2-Methyl-2-(cyanomethyl)-4-phenyl-6-hydroxy-7-methoxy-1,2,3,4-tetrahydroisoquinolinium

2-メチル-2-(シアノメチル)-4-フェニル-6-ヒドロキシ-7-メトキシ-1,2,3,4-テトラヒドロイソキノリニウム
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: C19H21N[N+]O2
Molecular formula furigana: C19-H21-N2-O2
Molecular weight: 309.388
InChI: InChI=1S/C19H20N2O2/c1-21(9-8-20)12-15-10-19(23-2)18(22)11-16(15)17(13-21)14-6-4-3-5-7-14/h3-7,10-11,17H,9,12-13H2,1-2H3/p+1
InChI key: HBBSWMSOGZNKRN-UHFFFAOYSA-O
SMILES: COc1cc2C[N+](C)(CC#N)CC(c3ccccc3)c2cc1O
Systematic name  (3):
  • 2-メチル-2-(シアノメチル)-4-フェニル-6-ヒドロキシ-7-メトキシ-1,2,3,4-テトラヒドロイソキノリニウム
  • 2-(シアノメチル)-6-ヒドロキシ-7-メトキシ-2-メチル-4-フェニル-1,2,3,4-テトラヒドロイソキノリン-2-イウム
  • 2-(cyanomethyl)-6-hydroxy-7-methoxy-2-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium
Other name (1):
  • 2-Methyl-2-(cyanomethyl)-4-phenyl-6-hydroxy-7-methoxy-1,2,3,4-tetrahydroisoquinolinium
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