3-methyl-5-(1-prop-2-enylpyridin-1-ium-4-yl)-1,2-oxazole chloride

Systemtic Name: 3-methyl-5-(1-prop-2-enylpyridin-1-ium-4-yl)-1,2-oxazole chloride Openeye Name: 5-(1-allylpyridin-1-ium-4-yl)-3-methyl-isoxazole chloride CAS Name: 3-methyl-5-(1-prop-2-enyl-4-pyridin-1-iumyl)isoxazole chloride IUPAC Name: 3-methyl-5-(1-prop-2-enylpyridin-1-ium-4-yl)-1,2-oxazole chloride Traditional Name: 5-(1-allylpyridin-1-ium-4-yl)-3-methyl-isoxazole chloride Formula: C12H13ClN2O MolecularWeight: 236.69742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C2=CC=[N+](C=C2)CC=C.[Cl-]

Isomeric SMILES

CC1=NOC(=C1)C2=CC=[N+](C=C2)CC=C.[Cl-]

InChI

InChI=1S/C12H13N2O.ClH/c1-3-6-14-7-4-11(5-8-14)12-9-10(2)13-15-12;/h3-5,7-9H,1,6H2,2H3;1H/q+1;/p-1