Products 2798945-85-2

CAS 2798945-85-2 is the registry number for (1S,2R,4S,5R)-1-(2-((4-Chloro-2-(trifluoromethyl)phenyl)amino)-2-oxoethyl)-2-((S)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium bromide, 98%. Offered by: Chemat Brand. Available pack sizes: on request.

(1S,2R,4S,5R)-1-(2-((4-Chloro-2-(trifluoromethyl)phenyl)amino)-2-oxoethyl)-2-((S)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium bromide, 98%
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[(1S)-5-ethenyl-2-[hydroxy(quinolin-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-1-yl]acetamide bromide (CAS 2798945-85-2) is a chemical compound with the molecular formula C28H28BrClF3N3O2 and a molecular weight of 610.9 g/mol. IUPAC name: N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[(1S)-5-ethenyl-2-[hydroxy(quinolin-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-1-yl]acetamide bromide. InChIKey: HVIQYBHEOHJXHT-YOHROQEXSA-N.

Identity
Molecular formulaC28H28BrClF3N3O2
Molecular weight610.9 g/mol
IUPAC nameN-[4-chloro-2-(trifluoromethyl)phenyl]-2-[(1S)-5-ethenyl-2-[hydroxy(quinolin-4-yl)methyl]-1-azoniabicyclo[2.2.2]octan-1-yl]acetamide bromide
InChIKeyHVIQYBHEOHJXHT-YOHROQEXSA-N
SMILESC=CC1C[N@@+]2(CCC1CC2C(C3=CC=NC4=CC=CC=C34)O)CC(=O)NC5=C(C=C(C=C5)Cl)C(F)(F)F.[Br-]

Computed by PubChem (NCBI)