1-(2-fluoranyl-4-methoxy-phenyl)-2-isoquinolin-2-ium-2-yl-ethanone

Systemtic Name: 1-(2-fluoranyl-4-methoxy-phenyl)-2-isoquinolin-2-ium-2-yl-ethanone Openeye Name: 1-(2-fluoro-4-methoxy-phenyl)-2-isoquinolin-2-ium-2-yl-ethanone CAS Name: 1-(2-fluoro-4-methoxyphenyl)-2-(2-isoquinolin-2-iumyl)ethanone IUPAC Name: 1-(2-fluoro-4-methoxyphenyl)-2-isoquinolin-2-ium-2-ylethanone Traditional Name: 1-(2-fluoro-4-methoxy-phenyl)-2-isoquinolin-2-ium-2-yl-ethanone Formula: C18H15FNO2+ MolecularWeight: 296.315603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C[N+]2=CC3=CC=CC=C3C=C2)F

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)C[N+]2=CC3=CC=CC=C3C=C2)F

InChI

InChI=1S/C18H15FNO2/c1-22-15-6-7-16(17(19)10-15)18(21)12-20-9-8-13-4-2-3-5-14(13)11-20/h2-11H,12H2,1H3/q+1