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Crystal structure of (3S*,4R*)-4-fluoro-3-(4-meth­oxy­phen­yl)-1-oxo-2-phenyl-1,2,3,4-tetra­hydro­iso­quinoline-4-carb­oxy­lic acid

The title compound, C(23)H(18)FNO(4), crystallized as a racemate. It exhibits a cis conformation with respect to the F atom and the methine H atom. The piperidine ring has a screw-boat conformation. The meth­oxy­phenyl ring and the phenyl ring are inclined to the mean plane of the iso­quinoline ring...

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Detalles Bibliográficos
Autores principales: Lehmann, Anna, Lechner, Lisa, Radacki, Krzysztof, Braunschweig, Holger, Holzgrabe, Ulrike
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2017
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5458312/
https://www.ncbi.nlm.nih.gov/pubmed/28638647
http://dx.doi.org/10.1107/S2056989017007186
Descripción
Sumario:The title compound, C(23)H(18)FNO(4), crystallized as a racemate. It exhibits a cis conformation with respect to the F atom and the methine H atom. The piperidine ring has a screw-boat conformation. The meth­oxy­phenyl ring and the phenyl ring are inclined to the mean plane of the iso­quinoline ring system by 89.85 (4) and 46.62 (5)°, respectively, and by 78.15 (5)° to one another. In the crystal, mol­ecules are linked by an O—H⋯O hydrogen bond forming chains propagating along the a-axis direction. The chains are linked by C—H⋯F hydrogen bonds, forming layers lying parallel to the ab plane.