Account (1R,2R)-2-(3-(tert-butoxy)-3-oxopropyl)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium benzenesulfonate
- Catalog No. :
- ACQDUK994
- CAS No. :
- 1075727-00-2
- Molecular Formula :
- C34H45NO9S
- Molecular Weight :
- 643.80
IUPAC Name:(1R,2R)-2-(3-(tert-butoxy)-3-oxopropyl)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium benzenesulfonate
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Product Information
| Product Name | (1R,2R)-2-(3-(tert-butoxy)-3-oxopropyl)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium benzenesulfonate |
|---|---|
| IUPAC Name | (1R,2R)-2-(3-(tert-butoxy)-3-oxopropyl)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium benzenesulfonate |
| Molecular Formula | C34H45NO9S |
| Molecular Weight | 643.80 |
| SMILES | COC1=C(OC)C=C(C[C@@H]2C3=CC(OC)=C(OC)C=C3CC[N@+]2(C)CCC(=O)OC(C)(C)C)C=C1.O=S(=O)([O-])C1=CC=CC=C1 |
| InChI Key | QDYZRXDXBZSEKV-OPMZCBONSA-M |
| Synonym | (1R,2R)-1-[(3,4-Dimethoxyphenyl)methyl]-2-[3-(tert-butoxy)-3-oxopropyl]-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methylisoquinolinium benzenesulfonate;Atracurium Impurity 25 Besylate;Cisatracurium quaternary ammonium salt;Atracurium Impurity 48;Cisatracurium Besilate Impurity 24;(1R,2R)-1-(3,4-Dimethoxybenzyl)-6,7-dimethoxy-2-methyl-2-{3-[(2-m ethyl-2-propanyl)oxy]-3-oxopropyl}-1,2,3,4-tetrahydroisoquinolini um benzenesulfonate;Cisquaternary Ammonium Salt;((1R,2R)-2-(3-(tert-butoxy)-3-oxopropyl)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium benzenesulfonate) |
| CAS No. | 1075727-00-2 |
Synthetic Route by SureRoute
2. ACQDUK994 Molecular Building Block Synthetic Route
(1R,2R)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-(3-methoxy-3-oxopropyl)-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium benzenesulfonate
2,2'-((Pentane-1,5-diylbis(oxy))bis(3-oxopropane-3,1-diyl))bis(1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium) benzenesulfonate
(1R,1'R,2R,2'R)-2,2'-((Pentane-1,5-diylbis(oxy))bis(3-oxopropane-3,1-diyl))bis(1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium) benzenesulfonate