[2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl] ethanesulfonate

Systemtic Name: [2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl] ethanesulfonate Openeye Name: [5-phenyl-2-(p-tolyl)pyrazol-3-yl] ethanesulfonate CAS Name: ethanesulfonic acid [2-(4-methylphenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(4-methylphenyl)-5-phenylpyrazol-3-yl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-phenyl-2-(p-tolyl)pyrazol-3-yl] ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC(=NN1C2=CC=C(C=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCS(=O)(=O)OC1=CC(=NN1C2=CC=C(C=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C18H18N2O3S/c1-3-24(21,22)23-18-13-17(15-7-5-4-6-8-15)19-20(18)16-11-9-14(2)10-12-16/h4-13H,3H2,1-2H3