2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-(6-methyl-1-oxidanidyl-pyridin-1-ium-2-yl)benzoic acid

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-(6-methyl-1-oxidanidyl-pyridin-1-ium-2-yl)benzoic acid Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-(6-methyl-1-oxido-pyridin-1-ium-2-yl)benzoic acid CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-(6-methyl-1-oxido-2-pyridin-1-iumyl)benzoic acid IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-(6-methyl-1-oxidopyridin-1-ium-2-yl)benzoic acid Traditional Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-(6-methyl-1-oxido-pyridin-1-ium-2-yl)benzoic acid Formula: C19H17N3O6 MolecularWeight: 383.35478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=[N+]1[O-])C2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)O

Isomeric SMILES

CC1=CC=CC(=[N+]1[O-])C2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)O

InChI

InChI=1S/C19H17N3O6/c1-11-6-4-8-13(22(11)25)12-7-5-9-14(17(12)18(23)24)28-19-20-15(26-2)10-16(21-19)27-3/h4-10H,1-3H3,(H,23,24)