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

Systemtic Name: 2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)ethanone iodide Openeye Name: 2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)ethanone iodide CAS Name: 2-(3-methyl-1-pyridin-1-iumyl)-1-(4-nitrophenyl)ethanone iodide IUPAC Name: 2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)ethanone iodide Traditional Name: 2-(3-methylpyridin-1-ium-1-yl)-1-(4-nitrophenyl)ethanone iodide Formula: C14H13IN2O3 MolecularWeight: 384.16909

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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