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

Systemtic Name: 2-methyl-5-methylsulfonyl-4-[(6-oxidanylidene-1H-pyridazin-3-yl)oxy]benzoic acid Openeye Name: 2-methyl-5-methylsulfonyl-4-[(6-oxo-1H-pyridazin-3-yl)oxy]benzoic acid CAS Name: 2-methyl-5-methylsulfonyl-4-[(6-oxo-1H-pyridazin-3-yl)oxy]benzoic acid IUPAC Name: 2-methyl-5-methylsulfonyl-4-[(6-oxo-1H-pyridazin-3-yl)oxy]benzoic acid Traditional Name: 4-[(6-keto-1H-pyridazin-3-yl)oxy]-5-mesyl-2-methyl-benzoic acid Formula: C13H12N2O6S MolecularWeight: 324.30918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)OC2=NNC(=O)C=C2

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)OC2=NNC(=O)C=C2

InChI

InChI=1S/C13H12N2O6S/c1-7-5-9(21-12-4-3-11(16)14-15-12)10(22(2,19)20)6-8(7)13(17)18/h3-6H,1-2H3,(H,14,16)(H,17,18)