5,6,7-trimethoxy-2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydroisoquinolin-2-ium iodide

Systemtic Name: 5,6,7-trimethoxy-2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydroisoquinolin-2-ium iodide Openeye Name: 5,6,7-trimethoxy-2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydroisoquinolin-2-ium iodide CAS Name: 5,6,7-trimethoxy-2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydroisoquinolin-2-ium iodide IUPAC Name: 5,6,7-trimethoxy-2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydroisoquinolin-2-ium iodide Traditional Name: 5,6,7-trimethoxy-2-methyl-1-(3,4,5-trimethoxybenzyl)-3,4-dihydroisoquinolin-2-ium iodide Formula: C23H30INO6 MolecularWeight: 543.39187

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=CC(=C(C(=C2CC1)OC)OC)OC)CC3=CC(=C(C(=C3)OC)OC)OC.[I-]

Isomeric SMILES

C[N+]1=C(C2=CC(=C(C(=C2CC1)OC)OC)OC)CC3=CC(=C(C(=C3)OC)OC)OC.[I-]

InChI

InChI=1S/C23H30NO6.HI/c1-24-9-8-15-16(13-20(27-4)23(30-7)21(15)28-5)17(24)10-14-11-18(25-2)22(29-6)19(12-14)26-3;/h11-13H,8-10H2,1-7H3;1H/q+1;/p-1