1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-2-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-2-oxidanylidene-pyridine-3-carboxylate Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-2-oxo-pyridine-3-carboxylate CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinecarboxylate IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-2-oxopyridine-3-carboxylate Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-2-keto-nicotinate Formula: C13H8ClFNO3- MolecularWeight: 280.658923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CN2C=CC=C(C2=O)C(=O)[O-])F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CN2C=CC=C(C2=O)C(=O)[O-])F

InChI

InChI=1S/C13H9ClFNO3/c14-10-4-1-5-11(15)9(10)7-16-6-2-3-8(12(16)17)13(18)19/h1-6H,7H2,(H,18,19)/p-1