5-[7-fluoranyl-6-nitro-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]pentanoic acid

Systemtic Name: 5-[7-fluoranyl-6-nitro-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]pentanoic acid Openeye Name: 5-(7-fluoro-6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)pentanoic acid CAS Name: 5-(7-fluoro-6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)pentanoic acid IUPAC Name: 5-(7-fluoro-6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)pentanoic acid Traditional Name: 5-(7-fluoro-2,3-diketo-6-nitro-4H-quinoxalin-1-yl)valeric acid Formula: C13H12FN3O6 MolecularWeight: 325.249283

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=CC(=C1[N+](=O)[O-])F)N(C(=O)C(=O)N2)CCCCC(=O)O

Isomeric SMILES

C1=C2C(=CC(=C1[N+](=O)[O-])F)N(C(=O)C(=O)N2)CCCCC(=O)O

InChI

InChI=1S/C13H12FN3O6/c14-7-5-10-8(6-9(7)17(22)23)15-12(20)13(21)16(10)4-2-1-3-11(18)19/h5-6H,1-4H2,(H,15,20)(H,18,19)