ethyl 2-(3-nitrophenyl)-6-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(3-nitrophenyl)-6-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-(3-nitrophenyl)-6-oxo-1H-pyrimidine-5-carboxylate CAS Name: 2-(3-nitrophenyl)-6-oxo-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-nitrophenyl)-6-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 6-keto-2-(3-nitrophenyl)-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C13H11N3O5 MolecularWeight: 289.24354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(NC1=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CN=C(NC1=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O5/c1-2-21-13(18)10-7-14-11(15-12(10)17)8-4-3-5-9(6-8)16(19)20/h3-7H,2H2,1H3,(H,14,15,17)