2-(chloromethyl)-4-methoxy-3,5-dimethyl-pyridin-1-ium chloride

Systemtic Name: 2-(chloromethyl)-4-methoxy-3,5-dimethyl-pyridin-1-ium chloride Openeye Name: 2-(chloromethyl)-4-methoxy-3,5-dimethyl-pyridin-1-ium chloride CAS Name: 2-(chloromethyl)-4-methoxy-3,5-dimethylpyridin-1-ium chloride IUPAC Name: 2-(chloromethyl)-4-methoxy-3,5-dimethylpyridin-1-ium chloride Traditional Name: 2-(chloromethyl)-4-methoxy-3,5-dimethyl-pyridin-1-ium chloride Formula: C9H13Cl2NO MolecularWeight: 222.11162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(C(=C1OC)C)CCl.[Cl-]

Isomeric SMILES

CC1=C[NH+]=C(C(=C1OC)C)CCl.[Cl-]

InChI

InChI=1S/C9H12ClNO.ClH/c1-6-5-11-8(4-10)7(2)9(6)12-3;/h5H,4H2,1-3H3;1H