6-[2-(3-bromanyl-4-fluoranyl-phenyl)ethenyl]-5-nitro-4-oxidanylidene-1H-pyrimidin-2-olate

Systemtic Name: 6-[2-(3-bromanyl-4-fluoranyl-phenyl)ethenyl]-5-nitro-4-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 6-[2-(3-bromo-4-fluoro-phenyl)vinyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate CAS Name: 6-[2-(3-bromo-4-fluorophenyl)ethenyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate IUPAC Name: 6-[2-(3-bromo-4-fluorophenyl)ethenyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate Traditional Name: 6-[2-(3-bromo-4-fluoro-phenyl)vinyl]-4-keto-5-nitro-1H-pyrimidin-2-olate Formula: C12H6BrFN3O4- MolecularWeight: 355.096143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC2=C(C(=O)N=C(N2)[O-])[N+](=O)[O-])Br)F

Isomeric SMILES

C1=CC(=C(C=C1C=CC2=C(C(=O)N=C(N2)[O-])[N+](=O)[O-])Br)F

InChI

InChI=1S/C12H7BrFN3O4/c13-7-5-6(1-3-8(7)14)2-4-9-10(17(20)21)11(18)16-12(19)15-9/h1-5H,(H2,15,16,18,19)/p-1