2-[(2,4-dichlorophenyl)methyl]-6,7-dimethoxy-isoquinolin-2-ium chloride

Systemtic Name: 2-[(2,4-dichlorophenyl)methyl]-6,7-dimethoxy-isoquinolin-2-ium chloride Openeye Name: 2-[(2,4-dichlorophenyl)methyl]-6,7-dimethoxy-isoquinolin-2-ium chloride CAS Name: 2-[(2,4-dichlorophenyl)methyl]-6,7-dimethoxyisoquinolin-2-ium chloride IUPAC Name: 2-[(2,4-dichlorophenyl)methyl]-6,7-dimethoxyisoquinolin-2-ium chloride Traditional Name: 2-(2,4-dichlorobenzyl)-6,7-dimethoxy-isoquinolin-2-ium chloride Formula: C18H16Cl3NO2 MolecularWeight: 384.68414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=[N+](C=CC2=C1)CC3=C(C=C(C=C3)Cl)Cl)OC.[Cl-]

Isomeric SMILES

COC1=C(C=C2C=[N+](C=CC2=C1)CC3=C(C=C(C=C3)Cl)Cl)OC.[Cl-]

InChI

InChI=1S/C18H16Cl2NO2.ClH/c1-22-17-7-12-5-6-21(11-14(12)8-18(17)23-2)10-13-3-4-15(19)9-16(13)20;/h3-9,11H,10H2,1-2H3;1H/q+1;/p-1