2-(5-oxidanylidene-4H-pyrazol-1-yl)benzene-1,4-disulfonic acid

Systemtic Name: 2-(5-oxidanylidene-4H-pyrazol-1-yl)benzene-1,4-disulfonic acid Openeye Name: 2-(5-oxo-4H-pyrazol-1-yl)benzene-1,4-disulfonic acid CAS Name: 2-(5-oxo-4H-pyrazol-1-yl)benzene-1,4-disulfonic acid IUPAC Name: 2-(5-oxo-4H-pyrazol-1-yl)benzene-1,4-disulfonic acid Traditional Name: 2-(5-keto-2-pyrazolin-1-yl)benzene-1,4-disulfonic acid Formula: C9H8N2O7S2 MolecularWeight: 320.29902

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Descriptors Computed from Structure

Canonical SMILES:

C1C=NN(C1=O)C2=C(C=CC(=C2)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1C=NN(C1=O)C2=C(C=CC(=C2)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C9H8N2O7S2/c12-9-3-4-10-11(9)7-5-6(19(13,14)15)1-2-8(7)20(16,17)18/h1-2,4-5H,3H2,(H,13,14,15)(H,16,17,18)