[2-[(6,7-dimethoxyisoquinolin-2-ium-1-yl)methyl]-4,5-dimethoxy-phenyl]methanol

Systemtic Name: [2-[(6,7-dimethoxyisoquinolin-2-ium-1-yl)methyl]-4,5-dimethoxy-phenyl]methanol Openeye Name: [2-[(6,7-dimethoxyisoquinolin-2-ium-1-yl)methyl]-4,5-dimethoxy-phenyl]methanol CAS Name: [2-[(6,7-dimethoxy-1-isoquinolin-2-iumyl)methyl]-4,5-dimethoxyphenyl]methanol IUPAC Name: [2-[(6,7-dimethoxyisoquinolin-2-ium-1-yl)methyl]-4,5-dimethoxyphenyl]methanol Traditional Name: [2-[(6,7-dimethoxyisoquinolin-2-ium-1-yl)methyl]-4,5-dimethoxy-phenyl]methanol Formula: C21H24NO5+ MolecularWeight: 370.41896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C[NH+]=C2CC3=CC(=C(C=C3CO)OC)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C[NH+]=C2CC3=CC(=C(C=C3CO)OC)OC)OC

InChI

InChI=1S/C21H23NO5/c1-24-18-8-13-5-6-22-17(16(13)11-21(18)27-4)7-14-9-19(25-2)20(26-3)10-15(14)12-23/h5-6,8-11,23H,7,12H2,1-4H3/p+1