2-phenyl-5-(phenylsulfonylmethyl)pyrazol-3-olate

Systemtic Name: 2-phenyl-5-(phenylsulfonylmethyl)pyrazol-3-olate Openeye Name: 5-(benzenesulfonylmethyl)-2-phenyl-pyrazol-3-olate CAS Name: 5-(benzenesulfonylmethyl)-2-phenyl-3-pyrazololate IUPAC Name: 5-(benzenesulfonylmethyl)-2-phenylpyrazol-3-olate Traditional Name: 5-(besylmethyl)-2-phenyl-pyrazol-3-olate Formula: C16H13N2O3S- MolecularWeight: 313.35102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CC(=N2)CS(=O)(=O)C3=CC=CC=C3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CC(=N2)CS(=O)(=O)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C16H14N2O3S/c19-16-11-13(17-18(16)14-7-3-1-4-8-14)12-22(20,21)15-9-5-2-6-10-15/h1-11,19H,12H2/p-1