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

Systemtic Name: 6-methoxy-2-methyl-7-phenylmethoxy-1-[(E)-2-(4-phenylmethoxyphenyl)ethenyl]-3,4-dihydroisoquinolin-2-ium iodide Openeye Name: 7-benzyloxy-1-[(E)-2-(4-benzyloxyphenyl)vinyl]-6-methoxy-2-methyl-3,4-dihydroisoquinolin-2-ium iodide CAS Name: 6-methoxy-2-methyl-7-phenylmethoxy-1-[(E)-2-(4-phenylmethoxyphenyl)ethenyl]-3,4-dihydroisoquinolin-2-ium iodide IUPAC Name: 6-methoxy-2-methyl-7-phenylmethoxy-1-[(E)-2-(4-phenylmethoxyphenyl)ethenyl]-3,4-dihydroisoquinolin-2-ium iodide Traditional Name: 7-benzoxy-1-[(E)-2-(4-benzoxyphenyl)vinyl]-6-methoxy-2-methyl-3,4-dihydroisoquinolin-2-ium iodide Formula: C33H32INO3 MolecularWeight: 617.51655

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H32NO3.HI/c1-34-20-19-28-21-32(35-2)33(37-24-27-11-7-4-8-12-27)22-30(28)31(34)18-15-25-13-16-29(17-14-25)36-23-26-9-5-3-6-10-26;/h3-18,21-22H,19-20,23-24H2,1-2H3;1H/q+1;/p-1/b18-15+;