6-methoxy-1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-2-methyl-7-phenylmethoxy-3,4-dihydroisoquinolin-2-ium iodide

Systemtic Name: 6-methoxy-1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-2-methyl-7-phenylmethoxy-3,4-dihydroisoquinolin-2-ium iodide Openeye Name: 7-benzyloxy-1-[(4-benzyloxy-3-methoxy-phenyl)methyl]-6-methoxy-2-methyl-3,4-dihydroisoquinolin-2-ium iodide CAS Name: 6-methoxy-1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-2-methyl-7-phenylmethoxy-3,4-dihydroisoquinolin-2-ium iodide IUPAC Name: 6-methoxy-1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-2-methyl-7-phenylmethoxy-3,4-dihydroisoquinolin-2-ium iodide Traditional Name: 7-benzoxy-1-(4-benzoxy-3-methoxy-benzyl)-6-methoxy-2-methyl-3,4-dihydroisoquinolin-2-ium iodide Formula: C33H34INO4 MolecularWeight: 635.53183

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=CC(=C(C=C2CC1)OC)OCC3=CC=CC=C3)CC4=CC(=C(C=C4)OCC5=CC=CC=C5)OC.[I-]

Isomeric SMILES

C[N+]1=C(C2=CC(=C(C=C2CC1)OC)OCC3=CC=CC=C3)CC4=CC(=C(C=C4)OCC5=CC=CC=C5)OC.[I-]

InChI

InChI=1S/C33H34NO4.HI/c1-34-17-16-27-20-32(36-3)33(38-23-25-12-8-5-9-13-25)21-28(27)29(34)18-26-14-15-30(31(19-26)35-2)37-22-24-10-6-4-7-11-24;/h4-15,19-21H,16-18,22-23H2,1-3H3;1H/q+1;/p-1