N-ethyl-3-fluoranyl-N-pyridin-1-ium-1-yl-pyridin-2-amine iodide

Systemtic Name: N-ethyl-3-fluoranyl-N-pyridin-1-ium-1-yl-pyridin-2-amine iodide Openeye Name: N-ethyl-3-fluoro-N-pyridin-1-ium-1-yl-pyridin-2-amine iodide CAS Name: N-ethyl-3-fluoro-N-(1-pyridin-1-iumyl)-2-pyridinamine iodide IUPAC Name: N-ethyl-3-fluoro-N-pyridin-1-ium-1-ylpyridin-2-amine iodide Traditional Name: ethyl-(3-fluoro-2-pyridyl)-pyridin-1-ium-1-yl-amine iodide Formula: C12H13FIN3 MolecularWeight: 345.154593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=CC=N1)F)[N+]2=CC=CC=C2.[I-]

Isomeric SMILES

CCN(C1=C(C=CC=N1)F)[N+]2=CC=CC=C2.[I-]

InChI

InChI=1S/C12H13FN3.HI/c1-2-16(15-9-4-3-5-10-15)12-11(13)7-6-8-14-12;/h3-10H,2H2,1H3;1H/q+1;/p-1