2-azanyl-6-fluoranyl-5-(1-methyl-2-oxidanylidene-pyridin-4-yl)-3-nitro-benzoic acid

Systemtic Name: 2-azanyl-6-fluoranyl-5-(1-methyl-2-oxidanylidene-pyridin-4-yl)-3-nitro-benzoic acid Openeye Name: 2-amino-6-fluoro-5-(1-methyl-2-oxo-4-pyridyl)-3-nitro-benzoic acid CAS Name: 2-amino-6-fluoro-5-(1-methyl-2-oxo-4-pyridinyl)-3-nitrobenzoic acid IUPAC Name: 2-amino-6-fluoro-5-(1-methyl-2-oxopyridin-4-yl)-3-nitrobenzoic acid Traditional Name: 2-amino-6-fluoro-5-(2-keto-1-methyl-4-pyridyl)-3-nitro-benzoic acid Formula: C13H10FN3O5 MolecularWeight: 307.234003

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=CC1=O)C2=CC(=C(C(=C2F)C(=O)O)N)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC(=CC1=O)C2=CC(=C(C(=C2F)C(=O)O)N)[N+](=O)[O-]

InChI

InChI=1S/C13H10FN3O5/c1-16-3-2-6(4-9(16)18)7-5-8(17(21)22)12(15)10(11(7)14)13(19)20/h2-5H,15H2,1H3,(H,19,20)