Crystal structure of [(2S)-1-[(3S)-3-carboxy-6,7-dimethoxy-1,2,3,4-tetra-hydroisoquinolin-2-yl]-1-oxopropan-2-yl][(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]azanium chloride acetonitrile monosolvate

The title compound (trivial name moexipril hydro-chloride) crystallizes as the aceto-nitrile monosolvate, C27H35N2O7 (+)·Cl(-)·C2H3N, with the salt comprising a U-shaped cation and a chloride anion. The conformation of the cation is stabilized by a weak intra-molecular N(+)-H⋯O hydrogen bond and the...

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Veröffentlicht in:Acta crystallographica. Section E, Structure reports online Structure reports online, 2014-10, Vol.70 (Pt 10), p.o1126-o1127
Hauptverfasser: Li, Ai-Zhen, Xu, Wen-Jie
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Sprache:eng
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Zusammenfassung:The title compound (trivial name moexipril hydro-chloride) crystallizes as the aceto-nitrile monosolvate, C27H35N2O7 (+)·Cl(-)·C2H3N, with the salt comprising a U-shaped cation and a chloride anion. The conformation of the cation is stabilized by a weak intra-molecular N(+)-H⋯O hydrogen bond and the tetra-hydro-pyridine ring adopts a boat conformation. The dihedral angle between the planes of the benzene rings is 85.6 (1)°. In the crystal, the cations and anions form tight ionic pairs by strong inter-molecular O-H⋯Cl hydrogen bonds. C-H⋯Cl and C-H⋯N hydrogen bonds link these ionic pairs and the aceto-nitrile solvate mol-ecules into puckered layers parallel to (100).
ISSN:1600-5368
1600-5368
DOI:10.1107/S160053681402090X