4-bromanyl-2-(4,6-dimethoxypyrimidin-2-yl)-5-methoxy-4H-pyridazin-2-ium-3-one

Systemtic Name: 4-bromanyl-2-(4,6-dimethoxypyrimidin-2-yl)-5-methoxy-4H-pyridazin-2-ium-3-one Openeye Name: 4-bromo-2-(4,6-dimethoxypyrimidin-2-yl)-5-methoxy-4H-pyridazin-2-ium-3-one CAS Name: 4-bromo-2-(4,6-dimethoxy-2-pyrimidinyl)-5-methoxy-4H-pyridazin-2-ium-3-one IUPAC Name: 4-bromo-2-(4,6-dimethoxypyrimidin-2-yl)-5-methoxy-4H-pyridazin-2-ium-3-one Traditional Name: 4-bromo-2-(4,6-dimethoxypyrimidin-2-yl)-5-methoxy-4H-pyridazin-2-ium-3-one Formula: C11H12BrN4O4+ MolecularWeight: 344.14138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)[N+]2=NC=C(C(C2=O)Br)OC)OC

Isomeric SMILES

COC1=CC(=NC(=N1)[N+]2=NC=C(C(C2=O)Br)OC)OC

InChI

InChI=1S/C11H12BrN4O4/c1-18-6-5-13-16(10(17)9(6)12)11-14-7(19-2)4-8(15-11)20-3/h4-5,9H,1-3H3/q+1