2-(4-methylpyridin-1-ium-1-yl)-1-(3-nitrophenyl)ethanone bromide

Systemtic Name: 2-(4-methylpyridin-1-ium-1-yl)-1-(3-nitrophenyl)ethanone bromide Openeye Name: 2-(4-methylpyridin-1-ium-1-yl)-1-(3-nitrophenyl)ethanone bromide CAS Name: 2-(4-methyl-1-pyridin-1-iumyl)-1-(3-nitrophenyl)ethanone bromide IUPAC Name: 2-(4-methylpyridin-1-ium-1-yl)-1-(3-nitrophenyl)ethanone bromide Traditional Name: 2-(4-methylpyridin-1-ium-1-yl)-1-(3-nitrophenyl)ethanone bromide Formula: C14H13BrN2O3 MolecularWeight: 337.16862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)CC(=O)C2=CC(=CC=C2)[N+](=O)[O-].[Br-]

Isomeric SMILES

CC1=CC=[N+](C=C1)CC(=O)C2=CC(=CC=C2)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C14H13N2O3.BrH/c1-11-5-7-15(8-6-11)10-14(17)12-3-2-4-13(9-12)16(18)19;/h2-9H,10H2,1H3;1H/q+1;/p-1