2-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)benzenesulfonate

Systemtic Name: 2-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)benzenesulfonate Openeye Name: 2-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonate CAS Name: 2-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonate IUPAC Name: 2-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonate Traditional Name: 2-(5-keto-3-methyl-2-pyrazolin-1-yl)besylate Formula: C10H9N2O4S- MolecularWeight: 253.25446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1)C2=CC=CC=C2S(=O)(=O)[O-]

Isomeric SMILES

CC1=NN(C(=O)C1)C2=CC=CC=C2S(=O)(=O)[O-]

InChI

InChI=1S/C10H10N2O4S/c1-7-6-10(13)12(11-7)8-4-2-3-5-9(8)17(14,15)16/h2-5H,6H2,1H3,(H,14,15,16)/p-1