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

Systemtic Name: 2-(5-methyl-3-oxidanylidene-1H-pyrazol-2-yl)benzenesulfonic acid Openeye Name: 2-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid CAS Name: 2-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid IUPAC Name: 2-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid Traditional Name: 2-(5-keto-3-methyl-3-pyrazolin-1-yl)besylic acid Formula: C10H10N2O4S MolecularWeight: 254.2624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1)C2=CC=CC=C2S(=O)(=O)O

Isomeric SMILES

CC1=CC(=O)N(N1)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/h2-6,11H,1H3,(H,14,15,16)