N-(3,5-dimethoxyphenyl)-2-isoquinolin-2-ium-2-yl-ethanamide chloride

Systemtic Name: N-(3,5-dimethoxyphenyl)-2-isoquinolin-2-ium-2-yl-ethanamide chloride Openeye Name: N-(3,5-dimethoxyphenyl)-2-isoquinolin-2-ium-2-yl-acetamide chloride CAS Name: N-(3,5-dimethoxyphenyl)-2-(2-isoquinolin-2-iumyl)acetamide chloride IUPAC Name: N-(3,5-dimethoxyphenyl)-2-isoquinolin-2-ium-2-ylacetamide chloride Traditional Name: N-(3,5-dimethoxyphenyl)-2-isoquinolin-2-ium-2-yl-acetamide chloride Formula: C19H19ClN2O3 MolecularWeight: 358.81876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)C[N+]2=CC3=CC=CC=C3C=C2)OC.[Cl-]

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)C[N+]2=CC3=CC=CC=C3C=C2)OC.[Cl-]

InChI

InChI=1S/C19H18N2O3.ClH/c1-23-17-9-16(10-18(11-17)24-2)20-19(22)13-21-8-7-14-5-3-4-6-15(14)12-21;/h3-12H,13H2,1-2H3;1H