1-(4-bromophenyl)-2-quinolin-1-ium-1-yl-propan-1-one bromide

Systemtic Name: 1-(4-bromophenyl)-2-quinolin-1-ium-1-yl-propan-1-one bromide Openeye Name: 1-(4-bromophenyl)-2-quinolin-1-ium-1-yl-propan-1-one bromide CAS Name: 1-(4-bromophenyl)-2-(1-quinolin-1-iumyl)-1-propanone bromide IUPAC Name: 1-(4-bromophenyl)-2-quinolin-1-ium-1-ylpropan-1-one bromide Traditional Name: 1-(4-bromophenyl)-2-quinolin-1-ium-1-yl-propan-1-one bromide Formula: C18H15Br2NO MolecularWeight: 421.1258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)Br)[N+]2=CC=CC3=CC=CC=C32.[Br-]

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)Br)[N+]2=CC=CC3=CC=CC=C32.[Br-]

InChI

InChI=1S/C18H15BrNO.BrH/c1-13(18(21)15-8-10-16(19)11-9-15)20-12-4-6-14-5-2-3-7-17(14)20;/h2-13H,1H3;1H/q+1;/p-1