Products 155913-32-9

CAS 155913-32-9 is the registry number for (1S,2R)-2-(3-((5-(Acryloyloxy)pentyl)oxy)-3-oxopropyl)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium Benzenesulfonate. Offered by: TRC. Available pack sizes: 50mg.

(1S,2R)-2-(3-((5-(Acryloyloxy)pentyl)oxy)-3-oxopropyl)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium Benzenesulfonate
TRC
  • size: 50mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

Benzenesulfonate;5-prop-2-enoyloxypentyl 3-[(1S,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoate (CAS 155913-32-9) is a chemical compound with the molecular formula C38H49NO11S and a molecular weight of 727.9 g/mol. IUPAC name: benzenesulfonate;5-prop-2-enoyloxypentyl 3-[(1S,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoate. InChIKey: OROOXZDLWOYLAH-SWRBPUJSSA-M.

Identity
Molecular formulaC38H49NO11S
Molecular weight727.9 g/mol
IUPAC namebenzenesulfonate;5-prop-2-enoyloxypentyl 3-[(1S,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoate
InChIKeyOROOXZDLWOYLAH-SWRBPUJSSA-M
SMILESC[N@@+]1(CCC2=CC(=C(C=C2[C@@H]1CC3=CC(=C(C=C3)OC)OC)OC)OC)CCC(=O)OCCCCCOC(=O)C=C.C1=CC=C(C=C1)S(=O)(=O)[O-]

Computed by PubChem (NCBI)

Synonyms: Atracurium Impurity 89, Cisatracurium Besylate Impurity 89
Related forms of this compound
benzenesulfonate;5-prop-2-enoyloxypentyl 3-[(1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoate C38H49NO11S
benzenesulfonate;5-prop-2-enoyloxypentyl 3-[(1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoate C38H49NO11S