2-(4-bromophenyl)-6-methyl-4-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-(4-bromophenyl)-6-methyl-4-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: 2-(4-bromophenyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylate CAS Name: 2-(4-bromophenyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylate IUPAC Name: 2-(4-bromophenyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 2-(4-bromophenyl)-4-keto-6-methyl-1H-pyrimidine-5-carboxylate Formula: C12H8BrN2O3- MolecularWeight: 308.10752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9BrN2O3/c1-6-9(12(17)18)11(16)15-10(14-6)7-2-4-8(13)5-3-7/h2-5H,1H3,(H,17,18)(H,14,15,16)/p-1