4-(3-methyl-5-oxidanylidene-pyrazol-4-yl)benzenesulfonic acid

Systemtic Name: 4-(3-methyl-5-oxidanylidene-pyrazol-4-yl)benzenesulfonic acid Openeye Name: 4-(3-methyl-5-oxo-pyrazol-4-yl)benzenesulfonic acid CAS Name: 4-(3-methyl-5-oxo-4-pyrazolyl)benzenesulfonic acid IUPAC Name: 4-(3-methyl-5-oxopyrazol-4-yl)benzenesulfonic acid Traditional Name: 4-(3-keto-5-methyl-pyrazol-4-yl)besylic acid Formula: C10H8N2O4S MolecularWeight: 252.24652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=N1)C2=CC=C(C=C2)S(=O)(=O)O

Isomeric SMILES

CC1=C(C(=O)N=N1)C2=CC=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C10H8N2O4S/c1-6-9(10(13)12-11-6)7-2-4-8(5-3-7)17(14,15)16/h2-5H,1H3,(H,14,15,16)