2,4,5-tris(chloranyl)-3-(5-methyl-3-oxidanylidene-1H-pyrazol-2-yl)benzenesulfonic acid

Systemtic Name: 2,4,5-tris(chloranyl)-3-(5-methyl-3-oxidanylidene-1H-pyrazol-2-yl)benzenesulfonic acid Openeye Name: 2,4,5-trichloro-3-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid CAS Name: 2,4,5-trichloro-3-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid IUPAC Name: 2,4,5-trichloro-3-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid Traditional Name: 2,4,5-trichloro-3-(5-keto-3-methyl-3-pyrazolin-1-yl)besylic acid Formula: C10H7Cl3N2O4S MolecularWeight: 357.59758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1)C2=C(C(=CC(=C2Cl)Cl)S(=O)(=O)O)Cl

Isomeric SMILES

CC1=CC(=O)N(N1)C2=C(C(=CC(=C2Cl)Cl)S(=O)(=O)O)Cl

InChI

InChI=1S/C10H7Cl3N2O4S/c1-4-2-7(16)15(14-4)10-8(12)5(11)3-6(9(10)13)20(17,18)19/h2-3,14H,1H3,(H,17,18,19)