2-(3,5-dimethylpyridin-1-ium-1-yl)ethanenitrile chloride

Systemtic Name: 2-(3,5-dimethylpyridin-1-ium-1-yl)ethanenitrile chloride Openeye Name: 2-(3,5-dimethylpyridin-1-ium-1-yl)acetonitrile chloride CAS Name: 2-(3,5-dimethyl-1-pyridin-1-iumyl)acetonitrile chloride IUPAC Name: 2-(3,5-dimethylpyridin-1-ium-1-yl)acetonitrile chloride Traditional Name: 2-(3,5-dimethylpyridin-1-ium-1-yl)acetonitrile chloride Formula: C9H11ClN2 MolecularWeight: 182.65004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11N2.ClH/c1-8-5-9(2)7-11(6-8)4-3-10;/h5-7H,4H2,1-2H3;1H/q+1;/p-1