N-[[2-(2-fluoranylphenoxy)pyridin-3-yl]methyl]-1-oxidanidyl-pyridin-1-ium-4-carboxamide

Systemtic Name: N-[[2-(2-fluoranylphenoxy)pyridin-3-yl]methyl]-1-oxidanidyl-pyridin-1-ium-4-carboxamide Openeye Name: N-[[2-(2-fluorophenoxy)-3-pyridyl]methyl]-1-oxido-pyridin-1-ium-4-carboxamide CAS Name: N-[[2-(2-fluorophenoxy)-3-pyridinyl]methyl]-1-oxido-4-pyridin-1-iumcarboxamide IUPAC Name: N-[[2-(2-fluorophenoxy)pyridin-3-yl]methyl]-1-oxidopyridin-1-ium-4-carboxamide Traditional Name: N-[[2-(2-fluorophenoxy)-3-pyridyl]methyl]-1-oxido-pyridin-1-ium-4-carboxamide Formula: C18H14FN3O3 MolecularWeight: 339.320463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OC2=C(C=CC=N2)CNC(=O)C3=CC=[N+](C=C3)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)OC2=C(C=CC=N2)CNC(=O)C3=CC=[N+](C=C3)[O-])F

InChI

InChI=1S/C18H14FN3O3/c19-15-5-1-2-6-16(15)25-18-14(4-3-9-20-18)12-21-17(23)13-7-10-22(24)11-8-13/h1-11H,12H2,(H,21,23)