6,7-dimethoxy-3-(3-methoxy-4-propan-2-yloxy-phenyl)-2-methyl-isoquinolin-2-ium

Systemtic Name: 6,7-dimethoxy-3-(3-methoxy-4-propan-2-yloxy-phenyl)-2-methyl-isoquinolin-2-ium Openeye Name: 3-(4-isopropoxy-3-methoxy-phenyl)-6,7-dimethoxy-2-methyl-isoquinolin-2-ium CAS Name: 6,7-dimethoxy-3-(3-methoxy-4-propan-2-yloxyphenyl)-2-methylisoquinolin-2-ium IUPAC Name: 6,7-dimethoxy-3-(3-methoxy-4-propan-2-yloxyphenyl)-2-methylisoquinolin-2-ium Traditional Name: 3-(4-isopropoxy-3-methoxy-phenyl)-6,7-dimethoxy-2-methyl-isoquinolin-2-ium Formula: C22H26NO4+ MolecularWeight: 368.44614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C2=CC3=CC(=C(C=C3C=[N+]2C)OC)OC)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C2=CC3=CC(=C(C=C3C=[N+]2C)OC)OC)OC

InChI

InChI=1S/C22H26NO4/c1-14(2)27-19-8-7-15(10-20(19)24-4)18-9-16-11-21(25-5)22(26-6)12-17(16)13-23(18)3/h7-14H,1-6H3/q+1