1-[[2-[(6,7-dimethoxy-2-methyl-isoquinolin-2-ium-1-yl)methyl]phenyl]methyl]-6,7-dimethoxy-2-methyl-isoquinolin-2-ium diiodide

Systemtic Name: 1-[[2-[(6,7-dimethoxy-2-methyl-isoquinolin-2-ium-1-yl)methyl]phenyl]methyl]-6,7-dimethoxy-2-methyl-isoquinolin-2-ium diiodide Openeye Name: 1-[[2-[(6,7-dimethoxy-2-methyl-isoquinolin-2-ium-1-yl)methyl]phenyl]methyl]-6,7-dimethoxy-2-methyl-isoquinolin-2-ium diiodide CAS Name: 1-[[2-[(6,7-dimethoxy-2-methyl-1-isoquinolin-2-iumyl)methyl]phenyl]methyl]-6,7-dimethoxy-2-methylisoquinolin-2-ium diiodide IUPAC Name: 1-[[2-[(6,7-dimethoxy-2-methylisoquinolin-2-ium-1-yl)methyl]phenyl]methyl]-6,7-dimethoxy-2-methylisoquinolin-2-ium diiodide Traditional Name: 1-[2-[(6,7-dimethoxy-2-methyl-isoquinolin-2-ium-1-yl)methyl]benzyl]-6,7-dimethoxy-2-methyl-isoquinolin-2-ium diiodide Formula: C32H34I2N2O4 MolecularWeight: 764.4323

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=CC(=C(C=C2C=C1)OC)OC)CC3=CC=CC=C3CC4=[N+](C=CC5=CC(=C(C=C54)OC)OC)C.[I-].[I-]

Isomeric SMILES

C[N+]1=C(C2=CC(=C(C=C2C=C1)OC)OC)CC3=CC=CC=C3CC4=[N+](C=CC5=CC(=C(C=C54)OC)OC)C.[I-].[I-]

InChI

InChI=1S/C32H34N2O4.2HI/c1-33-13-11-23-17-29(35-3)31(37-5)19-25(23)27(33)15-21-9-7-8-10-22(21)16-28-26-20-32(38-6)30(36-4)18-24(26)12-14-34(28)2;;/h7-14,17-20H,15-16H2,1-6H3;2*1H/q+2;;/p-2