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

Systemtic Name: 6-methyl-2-(4-nitrophenyl)-4-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: 6-methyl-2-(4-nitrophenyl)-4-oxo-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-(4-nitrophenyl)-4-oxo-1H-pyrimidine-5-carboxylate IUPAC Name: 6-methyl-2-(4-nitrophenyl)-4-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 4-keto-6-methyl-2-(4-nitrophenyl)-1H-pyrimidine-5-carboxylate Formula: C12H8N3O5- MolecularWeight: 274.20902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9N3O5/c1-6-9(12(17)18)11(16)14-10(13-6)7-2-4-8(5-3-7)15(19)20/h2-5H,1H3,(H,17,18)(H,13,14,16)/p-1