3-(3-chloranyl-6-oxidanylidene-pyridazin-1-yl)sulfonylbenzoic acid

Systemtic Name: 3-(3-chloranyl-6-oxidanylidene-pyridazin-1-yl)sulfonylbenzoic acid Openeye Name: 3-(3-chloro-6-oxo-pyridazin-1-yl)sulfonylbenzoic acid CAS Name: 3-[(3-chloro-6-oxo-1-pyridazinyl)sulfonyl]benzoic acid IUPAC Name: 3-(3-chloro-6-oxopyridazin-1-yl)sulfonylbenzoic acid Traditional Name: 3-(3-chloro-6-keto-pyridazin-1-yl)sulfonylbenzoic acid Formula: C11H7ClN2O5S MolecularWeight: 314.70168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H7ClN2O5S/c12-9-4-5-10(15)14(13-9)20(18,19)8-3-1-2-7(6-8)11(16)17/h1-6H,(H,16,17)