1-[5-(6,7-dimethoxy-2-methyl-isoquinolin-2-ium-1-yl)pentyl]-6,7-dimethoxy-2-methyl-isoquinolin-2-ium diiodide

Systemtic Name: 1-[5-(6,7-dimethoxy-2-methyl-isoquinolin-2-ium-1-yl)pentyl]-6,7-dimethoxy-2-methyl-isoquinolin-2-ium diiodide Openeye Name: 1-[5-(6,7-dimethoxy-2-methyl-isoquinolin-2-ium-1-yl)pentyl]-6,7-dimethoxy-2-methyl-isoquinolin-2-ium diiodide CAS Name: 1-[5-(6,7-dimethoxy-2-methyl-1-isoquinolin-2-iumyl)pentyl]-6,7-dimethoxy-2-methylisoquinolin-2-ium diiodide IUPAC Name: 1-[5-(6,7-dimethoxy-2-methylisoquinolin-2-ium-1-yl)pentyl]-6,7-dimethoxy-2-methylisoquinolin-2-ium diiodide Traditional Name: 1-[5-(6,7-dimethoxy-2-methyl-isoquinolin-2-ium-1-yl)pentyl]-6,7-dimethoxy-2-methyl-isoquinolin-2-ium diiodide Formula: C29H36I2N2O4 MolecularWeight: 730.41608

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=CC(=C(C=C2C=C1)OC)OC)CCCCCC3=[N+](C=CC4=CC(=C(C=C43)OC)OC)C.[I-].[I-]

Isomeric SMILES

C[N+]1=C(C2=CC(=C(C=C2C=C1)OC)OC)CCCCCC3=[N+](C=CC4=CC(=C(C=C43)OC)OC)C.[I-].[I-]

InChI

InChI=1S/C29H36N2O4.2HI/c1-30-14-12-20-16-26(32-3)28(34-5)18-22(20)24(30)10-8-7-9-11-25-23-19-29(35-6)27(33-4)17-21(23)13-15-31(25)2;;/h12-19H,7-11H2,1-6H3;2*1H/q+2;;/p-2