1-hexylpyridin-1-ium-4-carbonitrile

Systemtic Name: 1-hexylpyridin-1-ium-4-carbonitrile Openeye Name: 1-hexylpyridin-1-ium-4-carbonitrile CAS Name: 1-hexyl-4-pyridin-1-iumcarbonitrile IUPAC Name: 1-hexylpyridin-1-ium-4-carbonitrile Traditional Name: 1-hexylpyridin-1-ium-4-carbonitrile Formula: C12H17N2+ MolecularWeight: 189.27678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+]1=CC=C(C=C1)C#N

Isomeric SMILES

CCCCCC[N+]1=CC=C(C=C1)C#N

InChI

InChI=1S/C12H17N2/c1-2-3-4-5-8-14-9-6-12(11-13)7-10-14/h6-7,9-10H,2-5,8H2,1H3/q+1