1-(4-methoxypyridin-1-ium-1-yl)oxy-1-oxidanidyl-1-oxidanyl-1$l^{5},2-benziodoxol-3-one

Systemtic Name: 1-(4-methoxypyridin-1-ium-1-yl)oxy-1-oxidanidyl-1-oxidanyl-1$l^{5},2-benziodoxol-3-one Openeye Name: 1-hydroxy-1-(4-methoxypyridin-1-ium-1-yl)oxy-1-oxido-1$l^{5},2-benziodoxol-3-one CAS Name: 1-hydroxy-1-[(4-methoxy-1-pyridin-1-iumyl)oxy]-1-oxido-1$l^{5},2-benziodoxol-3-one IUPAC Name: 1-hydroxy-1-(4-methoxypyridin-1-ium-1-yl)oxy-1-oxido-1$l^{5},2-benziodoxol-3-one Traditional Name: 1-hydroxy-1-(4-methoxypyridin-1-ium-1-yl)oxy-1-oxido-1$l^{5},2-benziodoxol-3-one Formula: C13H12INO6 MolecularWeight: 405.14195

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=[N+](C=C1)OI2(C3=CC=CC=C3C(=O)O2)(O)[O-]

Isomeric SMILES

COC1=CC=[N+](C=C1)OI2(C3=CC=CC=C3C(=O)O2)(O)[O-]

InChI

InChI=1S/C13H12INO6/c1-19-10-6-8-15(9-7-10)21-14(17,18)12-5-3-2-4-11(12)13(16)20-14/h2-9,17H,1H3