ethyl [4-[(6-methoxy-2-methyl-7-phenylmethoxy-3,4-dihydroisoquinolin-2-ium-1-yl)methyl]-2-[4-[(6-methoxy-2-methyl-7-phenylmethoxy-3,4-dihydroisoquinolin-2-ium-1-yl)methyl]phenoxy]phenyl] carbonate

Systemtic Name: ethyl [4-[(6-methoxy-2-methyl-7-phenylmethoxy-3,4-dihydroisoquinolin-2-ium-1-yl)methyl]-2-[4-[(6-methoxy-2-methyl-7-phenylmethoxy-3,4-dihydroisoquinolin-2-ium-1-yl)methyl]phenoxy]phenyl] carbonate Openeye Name: [4-[(7-benzyloxy-6-methoxy-2-methyl-3,4-dihydroisoquinolin-2-ium-1-yl)methyl]-2-[4-[(7-benzyloxy-6-methoxy-2-methyl-3,4-dihydroisoquinolin-2-ium-1-yl)methyl]phenoxy]phenyl] ethyl carbonate CAS Name: carbonic acid ethyl [4-[(6-methoxy-2-methyl-7-phenylmethoxy-3,4-dihydroisoquinolin-2-ium-1-yl)methyl]-2-[4-[(6-methoxy-2-methyl-7-phenylmethoxy-3,4-dihydroisoquinolin-2-ium-1-yl)methyl]phenoxy]phenyl] ester IUPAC Name: ethyl [4-[(6-methoxy-2-methyl-7-phenylmethoxy-3,4-dihydroisoquinolin-2-ium-1-yl)methyl]-2-[4-[(6-methoxy-2-methyl-7-phenylmethoxy-3,4-dihydroisoquinolin-2-ium-1-yl)methyl]phenoxy]phenyl] carbonate Traditional Name: carbonic acid [4-[(7-benzoxy-6-methoxy-2-methyl-3,4-dihydroisoquinolin-2-ium-1-yl)methyl]-2-[4-[(7-benzoxy-6-methoxy-2-methyl-3,4-dihydroisoquinolin-2-ium-1-yl)methyl]phenoxy]phenyl] ethyl ester Formula: C53H54N2O8+2 MolecularWeight: 847.00446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC1=C(C=C(C=C1)CC2=[N+](CCC3=CC(=C(C=C32)OCC4=CC=CC=C4)OC)C)OC5=CC=C(C=C5)CC6=[N+](CCC7=CC(=C(C=C76)OCC8=CC=CC=C8)OC)C

Isomeric SMILES

CCOC(=O)OC1=C(C=C(C=C1)CC2=[N+](CCC3=CC(=C(C=C32)OCC4=CC=CC=C4)OC)C)OC5=CC=C(C=C5)CC6=[N+](CCC7=CC(=C(C=C76)OCC8=CC=CC=C8)OC)C

InChI

InChI=1S/C53H54N2O8/c1-6-59-53(56)63-47-22-19-39(28-46-44-33-51(61-35-38-15-11-8-12-16-38)49(58-5)31-41(44)24-26-55(46)3)29-52(47)62-42-20-17-36(18-21-42)27-45-43-32-50(60-34-37-13-9-7-10-14-37)48(57-4)30-40(43)23-25-54(45)2/h7-22,29-33H,6,23-28,34-35H2,1-5H3/q+2