2-[3-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide

Systemtic Name: 2-[3-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide Openeye Name: 2-[3-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide CAS Name: 2-[3-(2-methyl-1,3-dioxolan-2-yl)-1-pyridin-1-iumyl]-1-phenylethanone bromide IUPAC Name: 2-[3-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]-1-phenylethanone bromide Traditional Name: 2-[3-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide Formula: C17H18BrNO3 MolecularWeight: 364.23372

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCO1)C2=C[N+](=CC=C2)CC(=O)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CC1(OCCO1)C2=C[N+](=CC=C2)CC(=O)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C17H18NO3.BrH/c1-17(20-10-11-21-17)15-8-5-9-18(12-15)13-16(19)14-6-3-2-4-7-14;/h2-9,12H,10-11,13H2,1H3;1H/q+1;/p-1