dimethyl 2-azanyl-5-(3-nitrophenyl)carbonyl-pyrimidine-4,6-dicarboxylate

Systemtic Name: dimethyl 2-azanyl-5-(3-nitrophenyl)carbonyl-pyrimidine-4,6-dicarboxylate Openeye Name: dimethyl 2-amino-5-(3-nitrobenzoyl)pyrimidine-4,6-dicarboxylate CAS Name: 2-amino-5-[(3-nitrophenyl)-oxomethyl]pyrimidine-4,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-amino-5-(3-nitrobenzoyl)pyrimidine-4,6-dicarboxylate Traditional Name: 2-amino-5-(3-nitrobenzoyl)pyrimidine-4,6-dicarboxylic acid dimethyl ester Formula: C15H12N4O7 MolecularWeight: 360.27838

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=NC(=N1)N)C(=O)OC)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C(=NC(=N1)N)C(=O)OC)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O7/c1-25-13(21)10-9(11(14(22)26-2)18-15(16)17-10)12(20)7-4-3-5-8(6-7)19(23)24/h3-6H,1-2H3,(H2,16,17,18)