4-(1-methylpyridin-1-ium-2-yl)butan-2-one iodide

Systemtic Name: 4-(1-methylpyridin-1-ium-2-yl)butan-2-one iodide Openeye Name: 4-(1-methylpyridin-1-ium-2-yl)butan-2-one iodide CAS Name: 4-(1-methyl-2-pyridin-1-iumyl)-2-butanone iodide IUPAC Name: 4-(1-methylpyridin-1-ium-2-yl)butan-2-one iodide Traditional Name: 4-(1-methylpyridin-1-ium-2-yl)butan-2-one iodide Formula: C10H14INO MolecularWeight: 291.12873

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=CC=[N+]1C.[I-]

Isomeric SMILES

CC(=O)CCC1=CC=CC=[N+]1C.[I-]

InChI

InChI=1S/C10H14NO.HI/c1-9(12)6-7-10-5-3-4-8-11(10)2;/h3-5,8H,6-7H2,1-2H3;1H/q+1;/p-1