Bis(3-(1,2,3,4-tetrahydro-6,7-dimethoxy-N-methyl-1-(3,4,5-trimethoxybenzyl)isoquinolinium)propyl)1,3-phenylenedipropionate dichloride
[CAS# 71561-35-8]

Identification

• Name: Bis(3-(1,2,3,4-tetrahydro-6,7-dimethoxy-N-methyl-1-(3,4,5-trimethoxybenzyl)isoquinolinium)propyl)1,3-phenylenedipropionate dichloride
• Synonyms: 3-[6,7-Dimethoxy-2-Methyl-1-[(3,4,5-Trimethoxyphenyl)Methyl]-3,4-Dihydro-1H-Isoquinolin-2-Ium-2-Yl]Propyl 3-[3-[3-[3-[6,7-Dimethoxy-2-Methyl-1-[(3,4,5-Trimethoxyphenyl)Methyl]-3,4-Dihydro-1H-Isoquinolin-2-Ium-2-Yl]Propoxy]-3-Oxo-Propyl]Phenyl]Propanoate Dichloride; 3-[3-[3-[3-[6,7-Dimethoxy-2-Methyl-1-[(3,4,5-Trimethoxyphenyl)Methyl]-3,4-Dihydro-1H-Isoquinolin-2-Ium-2-Yl]Propoxy]-3-Oxopropyl]Phenyl]Propanoic Acid 3-[6,7-Dimethoxy-2-Methyl-1-[(3,4,5-Trimethoxyphenyl)Methyl]-3,4-Dihydro-1H-Isoquinolin-2-Ium-2-Yl]Propyl Ester Dichloride; 3-[3-[3-[3-[6,7-Dimethoxy-2-Methyl-1-(3,4,5-Trimethoxybenzyl)-3,4-Dihydro-1H-Isoquinolin-2-Ium-2-Yl]Propoxy]-3-Keto-Propyl]Phenyl]Propionic Acid 3-[6,7-Dimethoxy-2-Methyl-1-(3,4,5-Trimethoxybenzyl)-3,4-Dihydro-1H-Isoquinolin-2-Ium-2-Yl]Propyl Ester Dichloride
• Molecular Formula: C₆₂H₈₂Cl₂N₂O₁₄
• Molecular Weight: 1150.24
• CAS Registry Number: 71561-35-8
• SMILES: C1=C(C(=CC2=C1C([N+](CC2)(C)CCCOC(CCC3=CC(=CC=C3)CCC(=O)OCCC[N+]4(C(C5=C(CC4)C=C(C(=C5)OC)OC)CC6=CC(=C(C(=C6)OC)OC)OC)C)=O)CC7=CC(=C(C(=C7)OC)OC)OC)OC)OC.[Cl-].[Cl-]
• InChI: 1S/C62H82N2O14.2ClH/c1-63(26-22-45-37-51(67-3)53(69-5)39-47(45)49(63)31-43-33-55(71-7)61(75-11)56(34-43)72-8)24-14-28-77-59(65)20-18-41-16-13-17-42(30-41)19-21-60(66)78-29-15-25-64(2)27-23-46-38-52(68-4)54(70-6)40-48(46)50(64)32-44-35-57(73-9)62(76-12)58(36-44)74-10;;/h13,16-17,30,33-40,49-50H,14-15,18-29,31-32H2,1-12H3;2*1H/q+2;;/p-2
• InChIKey: IHNPCWAOUZRLGR-UHFFFAOYSA-L