2-[(5-oxidanylidene-4H-pyrazol-1-yl)methyl]benzenesulfonic acid

Systemtic Name: 2-[(5-oxidanylidene-4H-pyrazol-1-yl)methyl]benzenesulfonic acid Openeye Name: 2-[(5-oxo-4H-pyrazol-1-yl)methyl]benzenesulfonic acid CAS Name: 2-[(5-oxo-4H-pyrazol-1-yl)methyl]benzenesulfonic acid IUPAC Name: 2-[(5-oxo-4H-pyrazol-1-yl)methyl]benzenesulfonic acid Traditional Name: 2-[(5-keto-2-pyrazolin-1-yl)methyl]besylic acid Formula: C10H10N2O4S MolecularWeight: 254.2624

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Descriptors Computed from Structure

Canonical SMILES:

C1C=NN(C1=O)CC2=CC=CC=C2S(=O)(=O)O

Isomeric SMILES

C1C=NN(C1=O)CC2=CC=CC=C2S(=O)(=O)O

InChI

InChI=1S/C10H10N2O4S/c13-10-5-6-11-12(10)7-8-3-1-2-4-9(8)17(14,15)16/h1-4,6H,5,7H2,(H,14,15,16)