4-pyridin-1-ium-1-ylbutanenitrile chloride

Systemtic Name: 4-pyridin-1-ium-1-ylbutanenitrile chloride Openeye Name: 4-pyridin-1-ium-1-ylbutanenitrile chloride CAS Name: 4-(1-pyridin-1-iumyl)butanenitrile chloride IUPAC Name: 4-pyridin-1-ium-1-ylbutanenitrile chloride Traditional Name: 4-pyridin-1-ium-1-ylbutyronitrile chloride Formula: C9H11ClN2 MolecularWeight: 182.65004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11N2.ClH/c10-6-2-5-9-11-7-3-1-4-8-11;/h1,3-4,7-8H,2,5,9H2;1H/q+1;/p-1