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CAS 890023-13-9

:

1,2,5,6,7,8-Hexahydro-3-hydroxy-6,6-dimethyl-1-oxo-4-isoquinolinecarbonitrile

Description:
1,2,5,6,7,8-Hexahydro-3-hydroxy-6,6-dimethyl-1-oxo-4-isoquinolinecarbonitrile, with the CAS number 890023-13-9, is a chemical compound characterized by its complex bicyclic structure, which includes a hexahydroisoquinoline framework. This compound features multiple functional groups, including a hydroxyl group and a carbonitrile group, contributing to its potential reactivity and biological activity. The presence of dimethyl groups enhances its steric properties and may influence its solubility and interaction with biological targets. Typically, compounds of this nature may exhibit pharmacological properties, making them of interest in medicinal chemistry. The specific stereochemistry and spatial arrangement of substituents can significantly affect the compound's behavior in biological systems. Additionally, the compound's stability, solubility, and reactivity can vary based on environmental conditions such as pH and temperature. Overall, this compound represents a unique structure that may have applications in drug development or as a research tool in organic and medicinal chemistry.
Formula:C12H14N2O2
InChI:InChI=1S/C12H14N2O2/c1-12(2)4-3-7-8(5-12)9(6-13)11(16)14-10(7)15/h3-5H2,1-2H3,(H2,14,15,16)
InChI key:InChIKey=HMAQVGUVSOKPSH-UHFFFAOYSA-N
SMILES:O=C1C2=C(C(C#N)=C(O)N1)CC(C)(C)CC2
Synonyms:
  • 1,2,5,6,7,8-Hexahydro-3-hydroxy-6,6-dimethyl-1-oxo-4-isoquinolinecarbonitrile
  • 3-Hydroxy-6,6-dimethyl-1-oxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
  • 1,3-Dihydroxy-6,6-dimethyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
  • 4-Isoquinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-3-hydroxy-6,6-dimethyl-1-oxo-
  • 1-Hydroxy-6,6-dimethyl-3-oxo-2,5,7,8-tetrahydroisoquinoline-4-carbonitrile
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