[2-(3,4-dichlorophenyl)-5-phenyl-pyrazol-3-yl] quinoline-8-sulfonate

Systemtic Name: [2-(3,4-dichlorophenyl)-5-phenyl-pyrazol-3-yl] quinoline-8-sulfonate Openeye Name: [2-(3,4-dichlorophenyl)-5-phenyl-pyrazol-3-yl] quinoline-8-sulfonate CAS Name: 8-quinolinesulfonic acid [2-(3,4-dichlorophenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(3,4-dichlorophenyl)-5-phenylpyrazol-3-yl] quinoline-8-sulfonate Traditional Name: quinoline-8-sulfonic acid [2-(3,4-dichlorophenyl)-5-phenyl-pyrazol-3-yl] ester Formula: C24H15Cl2N3O3S MolecularWeight: 496.3652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=C2)OS(=O)(=O)C3=CC=CC4=C3N=CC=C4)C5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=C2)OS(=O)(=O)C3=CC=CC4=C3N=CC=C4)C5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C24H15Cl2N3O3S/c25-19-12-11-18(14-20(19)26)29-23(15-21(28-29)16-6-2-1-3-7-16)32-33(30,31)22-10-4-8-17-9-5-13-27-24(17)22/h1-15H