(7-fluoranyl-6-nitro-3,4-dihydro-2H-quinoxalin-1-yl) 2,3-bis(oxidanylidene)pentanoate

Systemtic Name: (7-fluoranyl-6-nitro-3,4-dihydro-2H-quinoxalin-1-yl) 2,3-bis(oxidanylidene)pentanoate Openeye Name: (7-fluoro-6-nitro-3,4-dihydro-2H-quinoxalin-1-yl) 2,3-dioxopentanoate CAS Name: 2,3-dioxopentanoic acid (7-fluoro-6-nitro-3,4-dihydro-2H-quinoxalin-1-yl) ester IUPAC Name: (7-fluoro-6-nitro-3,4-dihydro-2H-quinoxalin-1-yl) 2,3-dioxopentanoate Traditional Name: 2,3-diketovaleric acid (7-fluoro-6-nitro-3,4-dihydro-2H-quinoxalin-1-yl) ester Formula: C13H12FN3O6 MolecularWeight: 325.249283

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=O)C(=O)ON1CCNC2=CC(=C(C=C21)F)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)C(=O)C(=O)ON1CCNC2=CC(=C(C=C21)F)[N+](=O)[O-]

InChI

InChI=1S/C13H12FN3O6/c1-2-11(18)12(19)13(20)23-16-4-3-15-8-6-9(17(21)22)7(14)5-10(8)16/h5-6,15H,2-4H2,1H3