1-[(4-cyano-2-fluoranyl-phenyl)methyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[(4-cyano-2-fluoranyl-phenyl)methyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[(4-cyano-2-fluoro-phenyl)methyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[(4-cyano-2-fluorophenyl)methyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[(4-cyano-2-fluorophenyl)methyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-(4-cyano-2-fluoro-benzyl)pyridin-1-ium-3-carboxamide Formula: C14H11FN3O+ MolecularWeight: 256.255043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CC2=C(C=C(C=C2)C#N)F)C(=O)N

Isomeric SMILES

C1=CC(=C[N+](=C1)CC2=C(C=C(C=C2)C#N)F)C(=O)N

InChI

InChI=1S/C14H10FN3O/c15-13-6-10(7-16)3-4-11(13)8-18-5-1-2-12(9-18)14(17)19/h1-6,9H,8H2,(H-,17,19)/p+1