(2-chloranyl-6-fluoranyl-phenyl)methyl 2-azanyl-5-cyano-6-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 2-azanyl-5-cyano-6-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 2-amino-5-cyano-6-oxo-1H-pyridine-3-carboxylate CAS Name: 2-amino-5-cyano-6-oxo-1H-pyridine-3-carboxylic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 2-amino-5-cyano-6-oxo-1H-pyridine-3-carboxylate Traditional Name: 2-amino-5-cyano-6-keto-1H-pyridine-3-carboxylic acid (2-chloro-6-fluoro-benzyl) ester Formula: C14H9ClFN3O3 MolecularWeight: 321.690963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)COC(=O)C2=C(NC(=O)C(=C2)C#N)N)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)COC(=O)C2=C(NC(=O)C(=C2)C#N)N)F

InChI

InChI=1S/C14H9ClFN3O3/c15-10-2-1-3-11(16)9(10)6-22-14(21)8-4-7(5-17)13(20)19-12(8)18/h1-4H,6H2,(H3,18,19,20)