ethyl 6-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(5-nitro-2-oxo-1-pyridyl)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(5-nitro-2-oxo-1-pyridinyl)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(5-nitro-2-oxopyridin-1-yl)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[(2-keto-5-nitro-1-pyridyl)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C13H14N4O6 MolecularWeight: 322.27346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CN2C=C(C=CC2=O)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CN2C=C(C=CC2=O)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O6/c1-2-23-12(19)9-5-14-13(20)15-10(9)7-16-6-8(17(21)22)3-4-11(16)18/h3-4,6H,2,5,7H2,1H3,(H2,14,15,20)