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

Systemtic Name: 2,5-bis(chloranyl)-4-(5-oxidanylidene-3-phenyl-4H-pyrazol-1-yl)benzenesulfonic acid Openeye Name: 2,5-dichloro-4-(5-oxo-3-phenyl-4H-pyrazol-1-yl)benzenesulfonic acid CAS Name: 2,5-dichloro-4-(5-oxo-3-phenyl-4H-pyrazol-1-yl)benzenesulfonic acid IUPAC Name: 2,5-dichloro-4-(5-oxo-3-phenyl-4H-pyrazol-1-yl)benzenesulfonic acid Traditional Name: 2,5-dichloro-4-(5-keto-3-phenyl-2-pyrazolin-1-yl)besylic acid Formula: C15H10Cl2N2O4S MolecularWeight: 385.2219

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)C2=CC(=C(C=C2Cl)S(=O)(=O)O)Cl)C3=CC=CC=C3

Isomeric SMILES

C1C(=NN(C1=O)C2=CC(=C(C=C2Cl)S(=O)(=O)O)Cl)C3=CC=CC=C3

InChI

InChI=1S/C15H10Cl2N2O4S/c16-10-7-14(24(21,22)23)11(17)6-13(10)19-15(20)8-12(18-19)9-4-2-1-3-5-9/h1-7H,8H2,(H,21,22,23)