Chem
J-GLOBAL ID:200907088122750447
Nikkaji number:J2.215.314E
2-Methyl-2-(cyanomethyl)-6-hydroxy-7-methoxy-1,2,3,4-tetrahydroisoquinolinium
2-メチル-2-(シアノメチル)-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
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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:
C13 H17 N[N+]O2
Molecular formula furigana:
C13-H17-N2-O2
Molecular weight:
233.290
InChI:
InChI=1S/C13H16N2O2/c1-15(6-4-14)5-3-10-7-12(16)13(17-2)8-11(10)9-15/h7-8H,3,5-6,9H2,1-2H3/p+1
InChI key:
MATZKOKCSHUFQU-UHFFFAOYSA-O
SMILES:
COc1cc2C[N+](C)(CC#N)CCc2cc1O
Systematic name (3):
2-メチル-2-(シアノメチル)-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-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-1,2,3,4-tetrahydroisoquinolin-2-ium
Other name (1):
2-Methyl-2-(cyanomethyl)-6-hydroxy-7-methoxy-1,2,3,4-tetrahydroisoquinolinium
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