1-[1-[(2-bromophenyl)methyl]pyridin-1-ium-3-yl]ethanone

Systemtic Name: 1-[1-[(2-bromophenyl)methyl]pyridin-1-ium-3-yl]ethanone Openeye Name: 1-[1-[(2-bromophenyl)methyl]pyridin-1-ium-3-yl]ethanone CAS Name: 1-[1-[(2-bromophenyl)methyl]-3-pyridin-1-iumyl]ethanone IUPAC Name: 1-[1-[(2-bromophenyl)methyl]pyridin-1-ium-3-yl]ethanone Traditional Name: 1-[1-(2-bromobenzyl)pyridin-1-ium-3-yl]ethanone Formula: C14H13BrNO+ MolecularWeight: 291.16312

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C[N+](=CC=C1)CC2=CC=CC=C2Br

Isomeric SMILES

CC(=O)C1=C[N+](=CC=C1)CC2=CC=CC=C2Br

InChI

InChI=1S/C14H13BrNO/c1-11(17)12-6-4-8-16(9-12)10-13-5-2-3-7-14(13)15/h2-9H,10H2,1H3/q+1