4-methyl-1-(4-nitrophenyl)-6-oxidanylidene-pyrimidine-5-carboxylic acid

Systemtic Name: 4-methyl-1-(4-nitrophenyl)-6-oxidanylidene-pyrimidine-5-carboxylic acid Openeye Name: 4-methyl-1-(4-nitrophenyl)-6-oxo-pyrimidine-5-carboxylic acid CAS Name: 4-methyl-1-(4-nitrophenyl)-6-oxo-5-pyrimidinecarboxylic acid IUPAC Name: 4-methyl-1-(4-nitrophenyl)-6-oxopyrimidine-5-carboxylic acid Traditional Name: 6-keto-4-methyl-1-(4-nitrophenyl)pyrimidine-5-carboxylic acid Formula: C12H9N3O5 MolecularWeight: 275.21696

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