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CAS 52390-26-8

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(4aS,8aR)-2-benzoyl-1,3,4,4a,5,7,8,8a-octahydroisoquinolin-6-one

Description:
The chemical substance known as (4aS,8aR)-2-benzoyl-1,3,4,4a,5,7,8,8a-octahydroisoquinolin-6-one, with the CAS number 52390-26-8, is a complex organic compound characterized by its bicyclic structure, which includes an isoquinoline framework. This compound features a benzoyl group at the 2-position and a ketone functional group at the 6-position, contributing to its reactivity and potential biological activity. The stereochemistry indicated by the (4aS,8aR) notation suggests specific spatial arrangements of atoms, which can influence the compound's interactions in biological systems. Typically, such compounds may exhibit various pharmacological properties, making them of interest in medicinal chemistry. The presence of multiple chiral centers also implies that the compound may exist in different stereoisomeric forms, which can have distinct biological effects. Overall, the structural complexity and functional groups present in this compound suggest potential applications in drug development and synthesis.
Formula:C16H19NO2
InChI:InChI=1/C16H19NO2/c18-15-7-6-14-11-17(9-8-13(14)10-15)16(19)12-4-2-1-3-5-12/h1-5,13-14H,6-11H2/t13-,14-/m0/s1
SMILES:c1ccc(cc1)C(=O)N1CC[C@H]2CC(=O)CC[C@H]2C1
Synonyms:
  • (4aS,8aR)-2-Benzoyloctahydroisoquinolin-6(2H)-one
  • 6(2H)-isoquinolinone, 2-benzoyloctahydro-, (4aS,8aR)-
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