2-isoquinolin-2-ium-2-yl-1-(2-methoxy-5-methyl-phenyl)ethanone perchlorate

Systemtic Name: 2-isoquinolin-2-ium-2-yl-1-(2-methoxy-5-methyl-phenyl)ethanone perchlorate Openeye Name: 2-isoquinolin-2-ium-2-yl-1-(2-methoxy-5-methyl-phenyl)ethanone perchlorate CAS Name: 2-(2-isoquinolin-2-iumyl)-1-(2-methoxy-5-methylphenyl)ethanone perchlorate IUPAC Name: 2-isoquinolin-2-ium-2-yl-1-(2-methoxy-5-methylphenyl)ethanone perchlorate Traditional Name: 2-isoquinolin-2-ium-2-yl-1-(2-methoxy-5-methyl-phenyl)ethanone perchlorate Formula: C19H18ClNO6 MolecularWeight: 391.80232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(=O)C[N+]2=CC3=CC=CC=C3C=C2.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(=O)C[N+]2=CC3=CC=CC=C3C=C2.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C19H18NO2.ClHO4/c1-14-7-8-19(22-2)17(11-14)18(21)13-20-10-9-15-5-3-4-6-16(15)12-20;2-1(3,4)5/h3-12H,13H2,1-2H3;(H,2,3,4,5)/q+1;/p-1