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

Systemtic Name: 2-ethyl-5-methylsulfonyl-4-[(6-oxidanylidene-1H-pyridazin-3-yl)oxy]benzoic acid Openeye Name: 2-ethyl-5-methylsulfonyl-4-[(6-oxo-1H-pyridazin-3-yl)oxy]benzoic acid CAS Name: 2-ethyl-5-methylsulfonyl-4-[(6-oxo-1H-pyridazin-3-yl)oxy]benzoic acid IUPAC Name: 2-ethyl-5-methylsulfonyl-4-[(6-oxo-1H-pyridazin-3-yl)oxy]benzoic acid Traditional Name: 2-ethyl-4-[(6-keto-1H-pyridazin-3-yl)oxy]-5-mesyl-benzoic acid Formula: C14H14N2O6S MolecularWeight: 338.33576

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)OC2=NNC(=O)C=C2

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)OC2=NNC(=O)C=C2

InChI

InChI=1S/C14H14N2O6S/c1-3-8-6-10(22-13-5-4-12(17)15-16-13)11(23(2,20)21)7-9(8)14(18)19/h4-7H,3H2,1-2H3,(H,15,17)(H,18,19)