3-[(4-methylpiperidin-1-ium-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(4-methylpiperidin-1-ium-1-yl)methyl]benzenecarbonitrile Openeye Name: 3-[(4-methylpiperidin-1-ium-1-yl)methyl]benzonitrile CAS Name: 3-[(4-methyl-1-piperidin-1-iumyl)methyl]benzonitrile IUPAC Name: 3-[(4-methylpiperidin-1-ium-1-yl)methyl]benzonitrile Traditional Name: 3-[(4-methylpiperidin-1-ium-1-yl)methyl]benzonitrile Formula: C14H19N2+ MolecularWeight: 215.31406

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CC=CC(=C2)C#N

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CC=CC(=C2)C#N

InChI

InChI=1S/C14H18N2/c1-12-5-7-16(8-6-12)11-14-4-2-3-13(9-14)10-15/h2-4,9,12H,5-8,11H2,1H3/p+1