1-(2-hydroxyphenyl)-2-isoquinolin-2-ium-2-yl-ethanone bromide

Systemtic Name: 1-(2-hydroxyphenyl)-2-isoquinolin-2-ium-2-yl-ethanone bromide Openeye Name: 1-(2-hydroxyphenyl)-2-isoquinolin-2-ium-2-yl-ethanone bromide CAS Name: 1-(2-hydroxyphenyl)-2-(2-isoquinolin-2-iumyl)ethanone bromide IUPAC Name: 1-(2-hydroxyphenyl)-2-isoquinolin-2-ium-2-ylethanone bromide Traditional Name: 1-(2-hydroxyphenyl)-2-isoquinolin-2-ium-2-yl-ethanone bromide Formula: C17H14BrNO2 MolecularWeight: 344.20256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)C3=CC=CC=C3O.[Br-]

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)C3=CC=CC=C3O.[Br-]

InChI

InChI=1S/C17H13NO2.BrH/c19-16-8-4-3-7-15(16)17(20)12-18-10-9-13-5-1-2-6-14(13)11-18;/h1-11H,12H2;1H