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

Systemtic Name: 3-fluoranyl-4-[(4-methylpiperidin-1-ium-1-yl)methyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[(4-methylpiperidin-1-ium-1-yl)methyl]benzonitrile CAS Name: 3-fluoro-4-[(4-methyl-1-piperidin-1-iumyl)methyl]benzonitrile IUPAC Name: 3-fluoro-4-[(4-methylpiperidin-1-ium-1-yl)methyl]benzonitrile Traditional Name: 3-fluoro-4-[(4-methylpiperidin-1-ium-1-yl)methyl]benzonitrile Formula: C14H18FN2+ MolecularWeight: 233.304523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17FN2/c1-11-4-6-17(7-5-11)10-13-3-2-12(9-16)8-14(13)15/h2-3,8,11H,4-7,10H2,1H3/p+1