2-(4,6-dimethoxypyrimidin-2-yl)-4-oxidanyl-8aH-phthalazin-2-ium-1-one

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)-4-oxidanyl-8aH-phthalazin-2-ium-1-one Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)-4-hydroxy-8aH-phthalazin-2-ium-1-one CAS Name: 2-(4,6-dimethoxy-2-pyrimidinyl)-4-hydroxy-8aH-phthalazin-2-ium-1-one IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)-4-hydroxy-8aH-phthalazin-2-ium-1-one Traditional Name: 2-(4,6-dimethoxypyrimidin-2-yl)-4-hydroxy-8aH-phthalazin-2-ium-1-one Formula: C14H13N4O4+ MolecularWeight: 301.27742

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)[N+]2=NC(=C3C=CC=CC3C2=O)O)OC

Isomeric SMILES

COC1=CC(=NC(=N1)[N+]2=NC(=C3C=CC=CC3C2=O)O)OC

InChI

InChI=1S/C14H12N4O4/c1-21-10-7-11(22-2)16-14(15-10)18-13(20)9-6-4-3-5-8(9)12(19)17-18/h3-7,9H,1-2H3/p+1