1-[(5-fluoranyl-2-nitro-phenyl)methyl]-6-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-[(5-fluoranyl-2-nitro-phenyl)methyl]-6-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-[(5-fluoro-2-nitro-phenyl)methyl]-6-oxo-pyridine-3-carboxylic acid CAS Name: 1-[(5-fluoro-2-nitrophenyl)methyl]-6-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-[(5-fluoro-2-nitrophenyl)methyl]-6-oxopyridine-3-carboxylic acid Traditional Name: 1-(5-fluoro-2-nitro-benzyl)-6-keto-nicotinic acid Formula: C13H9FN2O5 MolecularWeight: 292.219363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)CN2C=C(C=CC2=O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1F)CN2C=C(C=CC2=O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H9FN2O5/c14-10-2-3-11(16(20)21)9(5-10)7-15-6-8(13(18)19)1-4-12(15)17/h1-6H,7H2,(H,18,19)