ChemSpider 2D Image | (1S,2R)-2-(3-{[(2Z)-2-chloro-4-{3-[(1R,2S)-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxybenzyl)-3,4-dihydroisoquinolinium-2(1H)-yl]propoxy}-4-oxobut-2-enoyl]oxy}propyl)-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroisoquinolinium dichloride | C53H69Cl3N2O14

(1S,2R)-2-(3-{[(2Z)-2-chloro-4-{3-[(1R,2S)-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxybenzyl)-3,4-dihydroisoquinolinium-2(1H)-yl]propoxy}-4-oxobut-2-enoyl]oxy}propyl)-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroisoquinolinium dichloride

  • Molecular FormulaC53H69Cl3N2O14
  • Average mass1064.479 Da
  • Monoisotopic mass1062.381470 Da
  • ChemSpider ID9978881

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(1S,2R)-2-(3-{[(2Z)-2-Chlor-4-{3-[(1R,2S)-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxybenzyl)-3,4-dihydro-2(1H)-isochinoliniumyl]propoxy}-4-oxo-2-butenoyl]oxy}propyl)-6,7-dimethoxy-2-methyl-1-(3,4,5-tri methoxyphenyl)-1,2,3,4-tetrahydroisochinoliniumdichlorid [German] [ACD/IUPAC Name]
(1S,2R)-2-(3-{[(2Z)-2-Chloro-4-{3-[(1R,2S)-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxybenzyl)-3,4-dihydro-2(1H)-isoquinoliniumyl]propoxy}-4-oxo-2-butenoyl]oxy}propyl)-6,7-dimethoxy-2-methyl-1-(3,4,5-tr imethoxyphenyl)-1,2,3,4-tetrahydroisoquinolinium dichloride [ACD/IUPAC Name]
(1S,2R)-2-(3-{[(2Z)-2-chloro-4-{3-[(1R,2S)-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxybenzyl)-3,4-dihydroisoquinolinium-2(1H)-yl]propoxy}-4-oxobut-2-enoyl]oxy}propyl)-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroisoquinolinium dichloride
Dichlorure de (1S,2R)-2-(3-{[(2Z)-2-chloro-4-{3-[(1R,2S)-6,7-diméthoxy-2-méthyl-1-(3,4,5-triméthoxybenzyl)-3,4-dihydro-2(1H)-isoquinoléiniumyl]propoxy}-4-oxo-2-butenoyl]oxy}propyl)-6,7-diméthoxy-2-mét hyl-1-(3,4,5-triméthoxyphényl)-1,2,3,4-tétrahydroisoquinoléinium [French] [ACD/IUPAC Name]
Isoquinolinium, 2-[3-[[(2Z)-3-chloro-4-[3-[(1S,2R)-3,4-dihydro-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxyphenyl)-2(1H)-isoquinoliniumyl]propoxy]-1,4-dioxo-2-buten-1-yl]oxy]propyl]-1,2,3,4-tetrahydro-6 ,7-dimethoxy-2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]-, chloride, (1R,2S)- (1:2) [ACD/Index Name]
isoquinolinium, 2-[3-[[(2Z)-3-chloro-4-[3-[(1S,2R)-3,4-dihydro-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxyphenyl)-2(1H)-isoquinoliniumyl]propoxy]-1,4-dioxo-2-buten-1-yl]oxy]propyl]-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]-, chloride, (1R,2S)- (1:2)
4-{3-[6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxybenzyl)-1,2,3,4-tetrahydro-2-isoquinoliniumyl]propyl} 1-{3-[6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydro-2-isoquinoliniumyl]propyl} 2-chloro-(Z)-2-butenedioate dichloride
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL413022/

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

No predicted properties have been calculated for this compound.

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