Products 155913-31-8

CAS 155913-31-8 appears in our catalog under these names: Atracurium Impurity 15 Iodide(Cisatracurium Besilate EP Impurity O Iodide), N-(5-(Propionyloxy)pentyl Acrylate) rac-cis-Laudanosine Benzenesulfonate. Offered by: Hubei YoungXin, TRC. Available pack sizes: 10mg, 25mg, 50mg, 100mg, 200mg.

Structural formula: {0} (CAS {1})

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 (CAS 155913-31-8) 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-[(1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoate. InChIKey: OROOXZDLWOYLAH-HRDILIDUSA-M.

Identity
Molecular formulaC38H49NO11S
Molecular weight727.9 g/mol
IUPAC namebenzenesulfonate;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
InChIKeyOROOXZDLWOYLAH-HRDILIDUSA-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)