6,7,8-trimethoxy-2,2-dimethyl-1-(naphthalen-2-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-ium iodide

Systemtic Name: 6,7,8-trimethoxy-2,2-dimethyl-1-(naphthalen-2-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-ium iodide Openeye Name: 6,7,8-trimethoxy-2,2-dimethyl-1-(2-naphthylmethyl)-3,4-dihydro-1H-isoquinolin-2-ium iodide CAS Name: 6,7,8-trimethoxy-2,2-dimethyl-1-(2-naphthalenylmethyl)-3,4-dihydro-1H-isoquinolin-2-ium iodide IUPAC Name: 6,7,8-trimethoxy-2,2-dimethyl-1-(naphthalen-2-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-ium iodide Traditional Name: 6,7,8-trimethoxy-2,2-dimethyl-1-(2-naphthylmethyl)-3,4-dihydro-1H-isoquinolin-2-ium iodide Formula: C25H30INO3 MolecularWeight: 519.41507

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC2=CC(=C(C(=C2C1CC3=CC4=CC=CC=C4C=C3)OC)OC)OC)C.[I-]

Isomeric SMILES

C[N+]1(CCC2=CC(=C(C(=C2C1CC3=CC4=CC=CC=C4C=C3)OC)OC)OC)C.[I-]

InChI

InChI=1S/C25H30NO3.HI/c1-26(2)13-12-20-16-22(27-3)24(28-4)25(29-5)23(20)21(26)15-17-10-11-18-8-6-7-9-19(18)14-17;/h6-11,14,16,21H,12-13,15H2,1-5H3;1H/q+1;/p-1