(2,5-diphenylpyrazol-3-yl) 4-methoxybenzenesulfonate

Systemtic Name: (2,5-diphenylpyrazol-3-yl) 4-methoxybenzenesulfonate Openeye Name: (2,5-diphenylpyrazol-3-yl) 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid (2,5-diphenyl-3-pyrazolyl) ester IUPAC Name: (2,5-diphenylpyrazol-3-yl) 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid (2,5-diphenylpyrazol-3-yl) ester Formula: C22H18N2O4S MolecularWeight: 406.45432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O4S/c1-27-19-12-14-20(15-13-19)29(25,26)28-22-16-21(17-8-4-2-5-9-17)23-24(22)18-10-6-3-7-11-18/h2-16H,1H3