Analyte Name

2-(2-Carboxyethyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methylisoquinolinium Sodium Salt Bromide

CAS Number

2260985-08-6

Molecular Formula

C24H32NNaO6 . Br

Molecular Weight

532.4

Accurate Mass

531.12

SMILES

COC1=C(C=C(C2=C1)CC[N+](C)(C2CC3=CC(OC)=C(C=C3)OC)CCC(O[Na])=O)OC.[Br-]

InChI

InChI=1S/C24H31NO6.BrH.Na/c1-25(11-9-24(26)27)10-8-17-14-22(30-4)23(31-5)15-18(17)19(25)12-16-6-7-20(28-2)21(13-16)29-3;;/h6-7,13-15,19H,8-12H2,1-5H3;1H;/q;;+1/p-1

IUPAC

2-(2-Carboxyethyl)-1-[(3,4-dimethoxyphenyl)methyl]-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methylisoquinolinium Sodium Salt Bromide

Alternate CAS Number

99469-29-1

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat