5-(1-ethylpyridin-1-ium-4-yl)-3-methyl-1,2-oxazole iodide

Systemtic Name: 5-(1-ethylpyridin-1-ium-4-yl)-3-methyl-1,2-oxazole iodide Openeye Name: 5-(1-ethylpyridin-1-ium-4-yl)-3-methyl-isoxazole iodide CAS Name: 5-(1-ethyl-4-pyridin-1-iumyl)-3-methylisoxazole iodide IUPAC Name: 5-(1-ethylpyridin-1-ium-4-yl)-3-methyl-1,2-oxazole iodide Traditional Name: 5-(1-ethylpyridin-1-ium-4-yl)-3-methyl-isoxazole iodide Formula: C11H13IN2O MolecularWeight: 316.13819

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=C(C=C1)C2=CC(=NO2)C.[I-]

Isomeric SMILES

CC[N+]1=CC=C(C=C1)C2=CC(=NO2)C.[I-]

InChI

InChI=1S/C11H13N2O.HI/c1-3-13-6-4-10(5-7-13)11-8-9(2)12-14-11;/h4-8H,3H2,1-2H3;1H/q+1;/p-1