ethyl 2-(2-ethoxy-5-nitro-phenyl)-6-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(2-ethoxy-5-nitro-phenyl)-6-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-(2-ethoxy-5-nitro-phenyl)-6-oxo-1H-pyrimidine-5-carboxylate CAS Name: 2-(2-ethoxy-5-nitrophenyl)-6-oxo-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-ethoxy-5-nitrophenyl)-6-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 2-(2-ethoxy-5-nitro-phenyl)-6-keto-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C15H15N3O6 MolecularWeight: 333.2961

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC=C(C(=O)N2)C(=O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC=C(C(=O)N2)C(=O)OCC

InChI

InChI=1S/C15H15N3O6/c1-3-23-12-6-5-9(18(21)22)7-10(12)13-16-8-11(14(19)17-13)15(20)24-4-2/h5-8H,3-4H2,1-2H3,(H,16,17,19)