1-pentadecylpyridin-1-ium-3-carbonitrile

Systemtic Name: 1-pentadecylpyridin-1-ium-3-carbonitrile Openeye Name: 1-pentadecylpyridin-1-ium-3-carbonitrile CAS Name: 1-pentadecyl-3-pyridin-1-iumcarbonitrile IUPAC Name: 1-pentadecylpyridin-1-ium-3-carbonitrile Traditional Name: 1-pentadecylpyridin-1-ium-3-carbonitrile Formula: C21H35N2+ MolecularWeight: 315.516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H35N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-23-18-15-16-21(19-22)20-23/h15-16,18,20H,2-14,17H2,1H3/q+1