6-methoxy-2,3-dimethyl-7-phenylmethoxy-1-[2-(3,4,5-trimethoxyphenyl)ethyl]-3,4-dihydroisoquinolin-2-ium iodide

Systemtic Name: 6-methoxy-2,3-dimethyl-7-phenylmethoxy-1-[2-(3,4,5-trimethoxyphenyl)ethyl]-3,4-dihydroisoquinolin-2-ium iodide Openeye Name: 7-benzyloxy-6-methoxy-2,3-dimethyl-1-[2-(3,4,5-trimethoxyphenyl)ethyl]-3,4-dihydroisoquinolin-2-ium iodide CAS Name: 6-methoxy-2,3-dimethyl-7-phenylmethoxy-1-[2-(3,4,5-trimethoxyphenyl)ethyl]-3,4-dihydroisoquinolin-2-ium iodide IUPAC Name: 6-methoxy-2,3-dimethyl-7-phenylmethoxy-1-[2-(3,4,5-trimethoxyphenyl)ethyl]-3,4-dihydroisoquinolin-2-ium iodide Traditional Name: 7-benzoxy-6-methoxy-2,3-dimethyl-1-[2-(3,4,5-trimethoxyphenyl)ethyl]-3,4-dihydroisoquinolin-2-ium iodide Formula: C30H36INO5 MolecularWeight: 617.51501

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC(=C(C=C2C(=[N+]1C)CCC3=CC(=C(C(=C3)OC)OC)OC)OCC4=CC=CC=C4)OC.[I-]

Isomeric SMILES

CC1CC2=CC(=C(C=C2C(=[N+]1C)CCC3=CC(=C(C(=C3)OC)OC)OC)OCC4=CC=CC=C4)OC.[I-]

InChI

InChI=1S/C30H36NO5.HI/c1-20-14-23-17-26(32-3)27(36-19-21-10-8-7-9-11-21)18-24(23)25(31(20)2)13-12-22-15-28(33-4)30(35-6)29(16-22)34-5;/h7-11,15-18,20H,12-14,19H2,1-6H3;1H/q+1;/p-1