2-[[2-(dimethylamino)pyridin-1-ium-4-yl]methylamino]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[[2-(dimethylamino)pyridin-1-ium-4-yl]methylamino]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[[2-(dimethylamino)pyridin-1-ium-4-yl]methylamino]-6-fluoro-benzonitrile CAS Name: 2-[[2-(dimethylamino)-4-pyridin-1-iumyl]methylamino]-6-fluorobenzonitrile IUPAC Name: 2-[[2-(dimethylamino)pyridin-1-ium-4-yl]methylamino]-6-fluorobenzonitrile Traditional Name: 2-[[2-(dimethylamino)pyridin-1-ium-4-yl]methylamino]-6-fluoro-benzonitrile Formula: C15H16FN4+ MolecularWeight: 271.312743

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=[NH+]C=CC(=C1)CNC2=C(C(=CC=C2)F)C#N

Isomeric SMILES

CN(C)C1=[NH+]C=CC(=C1)CNC2=C(C(=CC=C2)F)C#N

InChI

InChI=1S/C15H15FN4/c1-20(2)15-8-11(6-7-18-15)10-19-14-5-3-4-13(16)12(14)9-17/h3-8,19H,10H2,1-2H3/p+1