1-[(4-cyano-2-fluoranyl-phenyl)methyl]-6-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-[(4-cyano-2-fluoranyl-phenyl)methyl]-6-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-[(4-cyano-2-fluoro-phenyl)methyl]-6-oxo-pyridine-3-carboxylic acid CAS Name: 1-[(4-cyano-2-fluorophenyl)methyl]-6-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-[(4-cyano-2-fluorophenyl)methyl]-6-oxopyridine-3-carboxylic acid Traditional Name: 1-(4-cyano-2-fluoro-benzyl)-6-keto-nicotinic acid Formula: C14H9FN2O3 MolecularWeight: 272.231263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)F)CN2C=C(C=CC2=O)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C#N)F)CN2C=C(C=CC2=O)C(=O)O

InChI

InChI=1S/C14H9FN2O3/c15-12-5-9(6-16)1-2-10(12)7-17-8-11(14(19)20)3-4-13(17)18/h1-5,8H,7H2,(H,19,20)