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CAS 1272755-94-8

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2-(2-Oxo-1,4-diazaspiro[4.4]non-3-yl)benzonitrile

Description:
2-(2-Oxo-1,4-diazaspiro[4.4]non-3-yl)benzonitrile is a chemical compound characterized by its unique spirocyclic structure, which incorporates a diaza (two nitrogen atoms) framework. This compound features a benzonitrile moiety, indicating the presence of a benzene ring substituted with a nitrile group (-C≡N), contributing to its potential reactivity and applications in organic synthesis. The presence of the 2-oxo group suggests that it may exhibit keto-enol tautomerism, influencing its chemical behavior and interactions. The spiro structure can impart rigidity to the molecule, which may affect its biological activity and pharmacological properties. Compounds with similar structures are often investigated for their potential as pharmaceuticals or agrochemicals due to their ability to interact with biological targets. The specific arrangement of atoms and functional groups in 2-(2-Oxo-1,4-diazaspiro[4.4]non-3-yl)benzonitrile may also contribute to its solubility, stability, and overall reactivity, making it a subject of interest in medicinal chemistry and material science.
Formula:C14H15N3O
InChI:InChI=1S/C14H15N3O/c15-9-10-5-1-2-6-11(10)12-13(18)17-14(16-12)7-3-4-8-14/h1-2,5-6,12,16H,3-4,7-8H2,(H,17,18)
InChI key:InChIKey=VHODGGWNTRQBHM-UHFFFAOYSA-N
SMILES:O=C1NC2(NC1C3=C(C#N)C=CC=C3)CCCC2
Synonyms:
  • Benzonitrile, 2-(2-oxo-1,4-diazaspiro[4.4]non-3-yl)-
  • 2-(2-Oxo-1,4-diazaspiro[4.4]non-3-yl)benzonitrile
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