2-chloranyl-5-methylsulfonyl-4-[(6-oxidanylidene-1H-pyridazin-3-yl)oxy]benzoic acid

Systemtic Name: 2-chloranyl-5-methylsulfonyl-4-[(6-oxidanylidene-1H-pyridazin-3-yl)oxy]benzoic acid Openeye Name: 2-chloro-5-methylsulfonyl-4-[(6-oxo-1H-pyridazin-3-yl)oxy]benzoic acid CAS Name: 2-chloro-5-methylsulfonyl-4-[(6-oxo-1H-pyridazin-3-yl)oxy]benzoic acid IUPAC Name: 2-chloro-5-methylsulfonyl-4-[(6-oxo-1H-pyridazin-3-yl)oxy]benzoic acid Traditional Name: 2-chloro-4-[(6-keto-1H-pyridazin-3-yl)oxy]-5-mesyl-benzoic acid Formula: C12H9ClN2O6S MolecularWeight: 344.72766

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)O)Cl)OC2=NNC(=O)C=C2

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)O)Cl)OC2=NNC(=O)C=C2

InChI

InChI=1S/C12H9ClN2O6S/c1-22(19,20)9-4-6(12(17)18)7(13)5-8(9)21-11-3-2-10(16)14-15-11/h2-5H,1H3,(H,14,16)(H,17,18)