(5Z)-5-[(3-ethoxy-5-nitro-4-oxidanidyl-phenyl)methylidene]-4,6-bis(oxidanylidene)-1H-pyrimidin-2-olate

Systemtic Name: (5Z)-5-[(3-ethoxy-5-nitro-4-oxidanidyl-phenyl)methylidene]-4,6-bis(oxidanylidene)-1H-pyrimidin-2-olate Openeye Name: (5Z)-5-[(3-ethoxy-5-nitro-4-oxido-phenyl)methylene]-4,6-dioxo-1H-pyrimidin-2-olate CAS Name: (5Z)-5-[(3-ethoxy-5-nitro-4-oxidophenyl)methylidene]-4,6-dioxo-1H-pyrimidin-2-olate IUPAC Name: (5Z)-5-[(3-ethoxy-5-nitro-4-oxidophenyl)methylidene]-4,6-dioxo-1H-pyrimidin-2-olate Traditional Name: (5Z)-5-(3-ethoxy-5-nitro-4-oxido-benzylidene)-4,6-diketo-1H-pyrimidin-2-olate Formula: C13H9N3O7-2 MolecularWeight: 319.22646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C2C(=O)NC(=NC2=O)[O-]

Isomeric SMILES

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=C\2/C(=O)NC(=NC2=O)[O-]

InChI

InChI=1S/C13H11N3O7/c1-2-23-9-5-6(4-8(10(9)17)16(21)22)3-7-11(18)14-13(20)15-12(7)19/h3-5,17H,2H2,1H3,(H2,14,15,18,19,20)/p-2