Chem
J-GLOBAL ID：201707013390484485   Nikkaji number：J3.601.407E

4-[2-[(2-Hydroxybenzyl)amino]ethyl]-2,5-dimethoxybenzonitrile

4-[2-[(2-ヒドロキシベンジル)アミノ]エチル]-2,5-ジメトキシベンゾニトリル
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： C18H20N2O3
Molecular formula furigana： C18-H20-N2-O3
Molecular weight： 312.369
InChI： InChI=1S/C18H20N2O3/c1-22-17-10-15(11-19)18(23-2)9-13(17)7-8-20-12-14-5-3-4-6-16(14)21/h3-6,9-10,20-21H,7-8,12H2,1-2H3
InChI key： VWEDZTZAXHMZIL-UHFFFAOYSA-N
SMILES： COc1cc(C#N)c(OC)cc1CCNCc1ccccc1O
Systematic name  (3)：
  • 4-[2-[(2-ヒドロキシベンジル)アミノ]エチル]-2,5-ジメトキシベンゾニトリル
  • 4-(2-{[(2-ヒドロキシフェニル)メチル]アミノ}エチル)-2,5-ジメトキシベンゾニトリル
  • 4-(2-{[(2-hydroxyphenyl)methyl]amino}ethyl)-2,5-dimethoxybenzonitrile
Other name (1)：
  • 4-[2-[(2-Hydroxybenzyl)amino]ethyl]-2,5-dimethoxybenzonitrile
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