1-(2-pyridin-2-ylethyl)pyridin-1-ium-4-carbonitrile

Systemtic Name: 1-(2-pyridin-2-ylethyl)pyridin-1-ium-4-carbonitrile Openeye Name: 1-[2-(2-pyridyl)ethyl]pyridin-1-ium-4-carbonitrile CAS Name: 1-[2-(2-pyridinyl)ethyl]-4-pyridin-1-iumcarbonitrile IUPAC Name: 1-(2-pyridin-2-ylethyl)pyridin-1-ium-4-carbonitrile Traditional Name: 1-[2-(2-pyridyl)ethyl]pyridin-1-ium-4-carbonitrile Formula: C13H12N3+ MolecularWeight: 210.25448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CC[N+]2=CC=C(C=C2)C#N

Isomeric SMILES

C1=CC=NC(=C1)CC[N+]2=CC=C(C=C2)C#N

InChI

InChI=1S/C13H12N3/c14-11-12-4-8-16(9-5-12)10-6-13-3-1-2-7-15-13/h1-5,7-9H,6,10H2/q+1