3-ethoxy-7-(3-fluoranyl-4-oxidanylidene-pyridin-1-yl)-6-nitro-quinoxaline-2-carboxylate

Systemtic Name: 3-ethoxy-7-(3-fluoranyl-4-oxidanylidene-pyridin-1-yl)-6-nitro-quinoxaline-2-carboxylate Openeye Name: 3-ethoxy-7-(3-fluoro-4-oxo-1-pyridyl)-6-nitro-quinoxaline-2-carboxylate CAS Name: 3-ethoxy-7-(3-fluoro-4-oxo-1-pyridinyl)-6-nitro-2-quinoxalinecarboxylate IUPAC Name: 3-ethoxy-7-(3-fluoro-4-oxopyridin-1-yl)-6-nitroquinoxaline-2-carboxylate Traditional Name: 3-ethoxy-7-(3-fluoro-4-keto-1-pyridyl)-6-nitro-quinoxaline-2-carboxylate Formula: C16H10FN4O6- MolecularWeight: 373.272203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=CC(=C(C=C2N=C1C(=O)[O-])N3C=CC(=O)C(=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCOC1=NC2=CC(=C(C=C2N=C1C(=O)[O-])N3C=CC(=O)C(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C16H11FN4O6/c1-2-27-15-14(16(23)24)18-9-5-11(12(21(25)26)6-10(9)19-15)20-4-3-13(22)8(17)7-20/h3-7H,2H2,1H3,(H,23,24)/p-1