4-[(4-methylpyridin-1-ium-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(4-methylpyridin-1-ium-1-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(4-methylpyridin-1-ium-1-yl)methyl]benzonitrile CAS Name: 4-[(4-methyl-1-pyridin-1-iumyl)methyl]benzonitrile IUPAC Name: 4-[(4-methylpyridin-1-ium-1-yl)methyl]benzonitrile Traditional Name: 4-[(4-methylpyridin-1-ium-1-yl)methyl]benzonitrile Formula: C14H13N2+ MolecularWeight: 209.26642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)CC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=CC=[N+](C=C1)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H13N2/c1-12-6-8-16(9-7-12)11-14-4-2-13(10-15)3-5-14/h2-9H,11H2,1H3/q+1