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

Systemtic Name: 3-methylsulfonyl-4-[(6-oxidanylidene-1H-pyridazin-3-yl)oxy]benzoic acid Openeye Name: 3-methylsulfonyl-4-[(6-oxo-1H-pyridazin-3-yl)oxy]benzoic acid CAS Name: 3-methylsulfonyl-4-[(6-oxo-1H-pyridazin-3-yl)oxy]benzoic acid IUPAC Name: 3-methylsulfonyl-4-[(6-oxo-1H-pyridazin-3-yl)oxy]benzoic acid Traditional Name: 4-[(6-keto-1H-pyridazin-3-yl)oxy]-3-mesyl-benzoic acid Formula: C12H10N2O6S MolecularWeight: 310.2826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N2O6S/c1-21(18,19)9-6-7(12(16)17)2-3-8(9)20-11-5-4-10(15)13-14-11/h2-6H,1H3,(H,13,15)(H,16,17)