1,2,5,6,7,8-Hexahydro-3-hydroxy-6,6-dimethyl-1-oxo-4-isoquinolinecarbonitrile
CAS Registry Number®
890023-13-9
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CAS Name
1,2,5,6,7,8-Hexahydro-3-hydroxy-6,6-dimethyl-1-oxo-4-isoquinolinecarbonitrileMolecular Formula
C12H14N2O2Molecular Mass
218.25Cite this Page
1,2,5,6,7,8-Hexahydro-3-hydroxy-6,6-dimethyl-1-oxo-4-isoquinolinecarbonitrile. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=890023-13-9 (retrieved ) (CAS RN: 890023-13-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
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)
InChIKey
InChIKey=HMAQVGUVSOKPSH-UHFFFAOYSA-N
SMILES
O=C1C2=C(C(C#N)=C(O)N1)CC(C)(C)CC2
Canonical SMILES
N#CC1=C(O)NC(=O)C2=C1CC(C)(C)CC2
Other Names for this Substance
- 4-Isoquinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-3-hydroxy-6,6-dimethyl-1-oxo-
- 1,2,5,6,7,8-Hexahydro-3-hydroxy-6,6-dimethyl-1-oxo-4-isoquinolinecarbonitrile
- 1,3-Dihydroxy-6,6-dimethyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
- 1-Hydroxy-6,6-dimethyl-3-oxo-2,5,7,8-tetrahydroisoquinoline-4-carbonitrile
- 3-Hydroxy-6,6-dimethyl-1-oxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile