2-[[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]sulfonyl]-5-methoxy-benzoic acid

Systemtic Name: 2-[[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]sulfonyl]-5-methoxy-benzoic acid Openeye Name: 2-[(3,6-dioxo-1H-pyridazin-2-yl)sulfonyl]-5-methoxy-benzoic acid CAS Name: 2-[(3,6-dioxo-1H-pyridazin-2-yl)sulfonyl]-5-methoxybenzoic acid IUPAC Name: 2-[(3,6-dioxo-1H-pyridazin-2-yl)sulfonyl]-5-methoxybenzoic acid Traditional Name: 2-[(3,6-diketo-1H-pyridazin-2-yl)sulfonyl]-5-methoxy-benzoic acid Formula: C12H10N2O7S MolecularWeight: 326.282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S(=O)(=O)N2C(=O)C=CC(=O)N2)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)S(=O)(=O)N2C(=O)C=CC(=O)N2)C(=O)O

InChI

InChI=1S/C12H10N2O7S/c1-21-7-2-3-9(8(6-7)12(17)18)22(19,20)14-11(16)5-4-10(15)13-14/h2-6H,1H3,(H,13,15)(H,17,18)