1,6-dimethyl-4-oxidanidyl-3-pyridin-3-yl-pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione

Systemtic Name: 1,6-dimethyl-4-oxidanidyl-3-pyridin-3-yl-pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione Openeye Name: 1,6-dimethyl-4-oxido-3-(3-pyridyl)pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione CAS Name: 1,6-dimethyl-4-oxido-3-(3-pyridinyl)pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione IUPAC Name: 1,6-dimethyl-4-oxido-3-pyridin-3-ylpyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione Traditional Name: 1,6-dimethyl-4-oxido-3-(3-pyridyl)pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-quinone Formula: C12H10N6O3 MolecularWeight: 286.2462

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=O)N(C(=O)C2=[N+](C(=N1)C3=CN=CC=C3)[O-])C

Isomeric SMILES

CN1C2=NC(=O)N(C(=O)C2=[N+](C(=N1)C3=CN=CC=C3)[O-])C

InChI

InChI=1S/C12H10N6O3/c1-16-11(19)8-10(14-12(16)20)17(2)15-9(18(8)21)7-4-3-5-13-6-7/h3-6H,1-2H3