4-(5-carboxyoxy-3-oxidanylidene-1H-pyrazol-2-yl)benzenesulfonic acid

Systemtic Name: 4-(5-carboxyoxy-3-oxidanylidene-1H-pyrazol-2-yl)benzenesulfonic acid Openeye Name: 4-(5-carboxyoxy-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid CAS Name: 4-(5-carboxyoxy-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid IUPAC Name: 4-(5-carboxyoxy-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid Traditional Name: 4-(3-carboxyoxy-5-keto-3-pyrazolin-1-yl)besylic acid Formula: C10H8N2O7S MolecularWeight: 300.24472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C=C(N2)OC(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C=C(N2)OC(=O)O)S(=O)(=O)O

InChI

InChI=1S/C10H8N2O7S/c13-9-5-8(19-10(14)15)11-12(9)6-1-3-7(4-2-6)20(16,17)18/h1-5,11H,(H,14,15)(H,16,17,18)