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

Systemtic Name: 4-[(4-propylpyridin-1-ium-1-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(4-propylpyridin-1-ium-1-yl)methyl]benzonitrile CAS Name: 4-[(4-propyl-1-pyridin-1-iumyl)methyl]benzonitrile IUPAC Name: 4-[(4-propylpyridin-1-ium-1-yl)methyl]benzonitrile Traditional Name: 4-[(4-propylpyridin-1-ium-1-yl)methyl]benzonitrile Formula: C16H17N2+ MolecularWeight: 237.31958

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=[N+](C=C1)CC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCC1=CC=[N+](C=C1)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H17N2/c1-2-3-14-8-10-18(11-9-14)13-16-6-4-15(12-17)5-7-16/h4-11H,2-3,13H2,1H3/q+1