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

Systemtic Name: 2-(4-bromanyl-2-fluoranyl-phenyl)-6-methyl-4-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 2-(4-bromo-2-fluoro-phenyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 2-(4-bromo-2-fluorophenyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 2-(4-bromo-2-fluorophenyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-(4-bromo-2-fluoro-phenyl)-4-keto-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C12H8BrFN2O3 MolecularWeight: 327.105923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C2=C(C=C(C=C2)Br)F)C(=O)O

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C2=C(C=C(C=C2)Br)F)C(=O)O

InChI

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