2-(1-methylpiperidin-1-ium-4-yl)propanedinitrile chloride

Systemtic Name: 2-(1-methylpiperidin-1-ium-4-yl)propanedinitrile chloride Openeye Name: 2-(1-methylpiperidin-1-ium-4-yl)propanedinitrile chloride CAS Name: 2-(1-methyl-4-piperidin-1-iumyl)propanedinitrile chloride IUPAC Name: 2-(1-methylpiperidin-1-ium-4-yl)propanedinitrile chloride Traditional Name: 2-(1-methylpiperidin-1-ium-4-yl)malononitrile chloride Formula: C9H14ClN3 MolecularWeight: 199.68056

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)C(C#N)C#N.[Cl-]

Isomeric SMILES

C[NH+]1CCC(CC1)C(C#N)C#N.[Cl-]

InChI

InChI=1S/C9H13N3.ClH/c1-12-4-2-8(3-5-12)9(6-10)7-11;/h8-9H,2-5H2,1H3;1H