[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl] benzenesulfonate

Systemtic Name: [2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl] benzenesulfonate Openeye Name: [2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl] benzenesulfonate CAS Name: benzenesulfonic acid [2-(2-chlorophenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(2-chlorophenyl)-5-phenylpyrazol-3-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl] ester Formula: C21H15ClN2O3S MolecularWeight: 410.8734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=C2)OS(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=C2)OS(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H15ClN2O3S/c22-18-13-7-8-14-20(18)24-21(15-19(23-24)16-9-3-1-4-10-16)27-28(25,26)17-11-5-2-6-12-17/h1-15H