5-[(3-nitrophenyl)-(4-oxidanidyl-6-oxidanylidene-1H-pyrimidin-5-yl)methyl]-6-oxidanylidene-1H-pyrimidin-4-olate

Systemtic Name: 5-[(3-nitrophenyl)-(4-oxidanidyl-6-oxidanylidene-1H-pyrimidin-5-yl)methyl]-6-oxidanylidene-1H-pyrimidin-4-olate Openeye Name: 5-[(3-nitrophenyl)-(4-oxido-6-oxo-1H-pyrimidin-5-yl)methyl]-6-oxo-1H-pyrimidin-4-olate CAS Name: 5-[(3-nitrophenyl)-(4-oxido-6-oxo-1H-pyrimidin-5-yl)methyl]-6-oxo-1H-pyrimidin-4-olate IUPAC Name: 5-[(3-nitrophenyl)-(4-oxido-6-oxo-1H-pyrimidin-5-yl)methyl]-6-oxo-1H-pyrimidin-4-olate Traditional Name: 6-keto-5-[(6-keto-4-oxido-1H-pyrimidin-5-yl)-(3-nitrophenyl)methyl]-1H-pyrimidin-4-olate Formula: C15H9N5O6-2 MolecularWeight: 355.26186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(C2=C(N=CNC2=O)[O-])C3=C(N=CNC3=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(C2=C(N=CNC2=O)[O-])C3=C(N=CNC3=O)[O-]

InChI

InChI=1S/C15H11N5O6/c21-12-10(13(22)17-5-16-12)9(11-14(23)18-6-19-15(11)24)7-2-1-3-8(4-7)20(25)26/h1-6,9H,(H2,16,17,21,22)(H2,18,19,23,24)/p-2