2-(2-bromanyl-4-fluoranyl-phenyl)-6-methyl-4-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-(2-bromanyl-4-fluoranyl-phenyl)-6-methyl-4-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: 2-(2-bromo-4-fluoro-phenyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylate CAS Name: 2-(2-bromo-4-fluorophenyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylate IUPAC Name: 2-(2-bromo-4-fluorophenyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 2-(2-bromo-4-fluoro-phenyl)-4-keto-6-methyl-1H-pyrimidine-5-carboxylate Formula: C12H7BrFN2O3- MolecularWeight: 326.097983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C2=C(C=C(C=C2)F)Br)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C2=C(C=C(C=C2)F)Br)C(=O)[O-]

InChI

InChI=1S/C12H8BrFN2O3/c1-5-9(12(18)19)11(17)16-10(15-5)7-3-2-6(14)4-8(7)13/h2-4H,1H3,(H,18,19)(H,15,16,17)/p-1