1-[2,4-bis(fluoranyl)phenyl]-2-quinolin-1-ium-1-yl-ethanone chloride

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-2-quinolin-1-ium-1-yl-ethanone chloride Openeye Name: 1-(2,4-difluorophenyl)-2-quinolin-1-ium-1-yl-ethanone chloride CAS Name: 1-(2,4-difluorophenyl)-2-(1-quinolin-1-iumyl)ethanone chloride IUPAC Name: 1-(2,4-difluorophenyl)-2-quinolin-1-ium-1-ylethanone chloride Traditional Name: 1-(2,4-difluorophenyl)-2-quinolin-1-ium-1-yl-ethanone chloride Formula: C17H12ClF2NO MolecularWeight: 319.733086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=[N+]2CC(=O)C3=C(C=C(C=C3)F)F.[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=[N+]2CC(=O)C3=C(C=C(C=C3)F)F.[Cl-]

InChI

InChI=1S/C17H12F2NO.ClH/c18-13-7-8-14(15(19)10-13)17(21)11-20-9-3-5-12-4-1-2-6-16(12)20;/h1-10H,11H2;1H/q+1;/p-1