3-fluoranyl-4-(piperidin-1-ium-1-ylmethyl)benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-(piperidin-1-ium-1-ylmethyl)benzenecarbonitrile Openeye Name: 3-fluoro-4-(piperidin-1-ium-1-ylmethyl)benzonitrile CAS Name: 3-fluoro-4-(1-piperidin-1-iumylmethyl)benzonitrile IUPAC Name: 3-fluoro-4-(piperidin-1-ium-1-ylmethyl)benzonitrile Traditional Name: 3-fluoro-4-(piperidin-1-ium-1-ylmethyl)benzonitrile Formula: C13H16FN2+ MolecularWeight: 219.277943

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

C1CC[NH+](CC1)CC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C13H15FN2/c14-13-8-11(9-15)4-5-12(13)10-16-6-2-1-3-7-16/h4-5,8H,1-3,6-7,10H2/p+1