3-[[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]sulfonyl]-4-chloranyl-benzoic acid

Systemtic Name: 3-[[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]sulfonyl]-4-chloranyl-benzoic acid Openeye Name: 4-chloro-3-[(3,6-dioxo-1H-pyridazin-2-yl)sulfonyl]benzoic acid CAS Name: 4-chloro-3-[(3,6-dioxo-1H-pyridazin-2-yl)sulfonyl]benzoic acid IUPAC Name: 4-chloro-3-[(3,6-dioxo-1H-pyridazin-2-yl)sulfonyl]benzoic acid Traditional Name: 4-chloro-3-[(3,6-diketo-1H-pyridazin-2-yl)sulfonyl]benzoic acid Formula: C11H7ClN2O6S MolecularWeight: 330.70108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)S(=O)(=O)N2C(=O)C=CC(=O)N2)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)S(=O)(=O)N2C(=O)C=CC(=O)N2)Cl

InChI

InChI=1S/C11H7ClN2O6S/c12-7-2-1-6(11(17)18)5-8(7)21(19,20)14-10(16)4-3-9(15)13-14/h1-5H,(H,13,15)(H,17,18)