1-dodecylpyridin-1-ium-4-carbonitrile

Systemtic Name: 1-dodecylpyridin-1-ium-4-carbonitrile Openeye Name: 1-dodecylpyridin-1-ium-4-carbonitrile CAS Name: 1-dodecyl-4-pyridin-1-iumcarbonitrile IUPAC Name: 1-dodecylpyridin-1-ium-4-carbonitrile Traditional Name: 1-laurylpyridin-1-ium-4-carbonitrile Formula: C18H29N2+ MolecularWeight: 273.43626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N2/c1-2-3-4-5-6-7-8-9-10-11-14-20-15-12-18(17-19)13-16-20/h12-13,15-16H,2-11,14H2,1H3/q+1