3-(1,3-benzodioxol-5-yl)-6-methyl-5-oxidanylidene-pyrimido[5,4-e][1,2,4]triazin-7-olate

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-6-methyl-5-oxidanylidene-pyrimido[5,4-e][1,2,4]triazin-7-olate Openeye Name: 3-(1,3-benzodioxol-5-yl)-6-methyl-5-oxo-pyrimido[5,4-e][1,2,4]triazin-7-olate CAS Name: 3-(1,3-benzodioxol-5-yl)-6-methyl-5-oxo-7-pyrimido[5,4-e][1,2,4]triazinolate IUPAC Name: 3-(1,3-benzodioxol-5-yl)-6-methyl-5-oxopyrimido[5,4-e][1,2,4]triazin-7-olate Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-keto-6-methyl-pyrimido[5,4-e][1,2,4]triazin-7-olate Formula: C13H8N5O4- MolecularWeight: 298.23372

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1[O-])N=NC(=N2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C(=O)C2=C(N=C1[O-])N=NC(=N2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C13H9N5O4/c1-18-12(19)9-11(15-13(18)20)17-16-10(14-9)6-2-3-7-8(4-6)22-5-21-7/h2-4H,5H2,1H3,(H,15,17,20)/p-1