5-phenyl-4-(2-triphenylphosphaniumylethanoyl)-1H-pyrazol-3-olate

Systemtic Name: 5-phenyl-4-(2-triphenylphosphaniumylethanoyl)-1H-pyrazol-3-olate Openeye Name: 5-phenyl-4-(2-triphenylphosphaniumylacetyl)-1H-pyrazol-3-olate CAS Name: 4-(1-oxo-2-triphenylphosphiniumylethyl)-5-phenyl-1H-pyrazol-3-olate IUPAC Name: 5-phenyl-4-(2-triphenylphosphaniumylacetyl)-1H-pyrazol-3-olate Traditional Name: 5-phenyl-4-(2-triphenylphosphiniumylacetyl)-1H-pyrazol-3-olate Formula: C29H23N2O2P MolecularWeight: 462.478881

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NN2)[O-])C(=O)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NN2)[O-])C(=O)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H23N2O2P/c32-26(27-28(30-31-29(27)33)22-13-5-1-6-14-22)21-34(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-20H,21H2,(H-,30,31,32,33)