2-chloranyl-3-(1H-imidazol-3-ium-3-yl)propanenitrile chloride

Systemtic Name: 2-chloranyl-3-(1H-imidazol-3-ium-3-yl)propanenitrile chloride Openeye Name: 2-chloro-3-(1H-imidazol-3-ium-3-yl)propanenitrile chloride CAS Name: 2-chloro-3-(1H-imidazol-3-ium-3-yl)propanenitrile chloride IUPAC Name: 2-chloro-3-(1H-imidazol-3-ium-3-yl)propanenitrile chloride Traditional Name: 2-chloro-3-(1H-imidazol-3-ium-3-yl)propionitrile chloride Formula: C6H7Cl2N3 MolecularWeight: 192.04588

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CN1)CC(C#N)Cl.[Cl-]

Isomeric SMILES

C1=C[N+](=CN1)CC(C#N)Cl.[Cl-]

InChI

InChI=1S/C6H6ClN3.ClH/c7-6(3-8)4-10-2-1-9-5-10;/h1-2,5-6H,4H2;1H