1-[[3,4-bis(fluoranyl)phenyl]methyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: 1-[[3,4-bis(fluoranyl)phenyl]methyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: 1-[(3,4-difluorophenyl)methyl]-6-oxo-pyridine-3-carboxylate CAS Name: 1-[(3,4-difluorophenyl)methyl]-6-oxo-3-pyridinecarboxylate IUPAC Name: 1-[(3,4-difluorophenyl)methyl]-6-oxopyridine-3-carboxylate Traditional Name: 1-(3,4-difluorobenzyl)-6-keto-nicotinate Formula: C13H8F2NO3- MolecularWeight: 264.204326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CN2C=C(C=CC2=O)C(=O)[O-])F)F

Isomeric SMILES

C1=CC(=C(C=C1CN2C=C(C=CC2=O)C(=O)[O-])F)F

InChI

InChI=1S/C13H9F2NO3/c14-10-3-1-8(5-11(10)15)6-16-7-9(13(18)19)2-4-12(16)17/h1-5,7H,6H2,(H,18,19)/p-1