4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-2-methyl-isoquinolin-2-ium iodide

Systemtic Name: 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-2-methyl-isoquinolin-2-ium iodide Openeye Name: 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-2-methyl-isoquinolin-2-ium iodide CAS Name: 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-2-methylisoquinolin-2-ium iodide IUPAC Name: 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-2-methylisoquinolin-2-ium iodide Traditional Name: 4-(4-chlorobenzyl)-6,7-dimethoxy-2-methyl-isoquinolin-2-ium iodide Formula: C19H19ClINO2 MolecularWeight: 455.71713

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC2=CC(=C(C=C2C(=C1)CC3=CC=C(C=C3)Cl)OC)OC.[I-]

Isomeric SMILES

C[N+]1=CC2=CC(=C(C=C2C(=C1)CC3=CC=C(C=C3)Cl)OC)OC.[I-]

InChI

InChI=1S/C19H19ClNO2.HI/c1-21-11-14(8-13-4-6-16(20)7-5-13)17-10-19(23-3)18(22-2)9-15(17)12-21;/h4-7,9-12H,8H2,1-3H3;1H/q+1;/p-1