1-hexadecylpyridin-1-ium-4-carbonitrile

Systemtic Name: 1-hexadecylpyridin-1-ium-4-carbonitrile Openeye Name: 1-hexadecylpyridin-1-ium-4-carbonitrile CAS Name: 1-hexadecyl-4-pyridin-1-iumcarbonitrile IUPAC Name: 1-hexadecylpyridin-1-ium-4-carbonitrile Traditional Name: 1-cetylpyridin-1-ium-4-carbonitrile Formula: C22H37N2+ MolecularWeight: 329.54258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H37N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-24-19-16-22(21-23)17-20-24/h16-17,19-20H,2-15,18H2,1H3/q+1