triphenyl-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phosphanium bromide

Systemtic Name: triphenyl-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phosphanium bromide Openeye Name: triphenyl-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phosphonium bromide CAS Name: triphenyl-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phosphonium bromide IUPAC Name: triphenyl-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phosphanium bromide Traditional Name: triphenyl-(5-phenyl-2-pyrazolin-3-yl)phosphonium bromide Formula: C27H24BrN2P MolecularWeight: 487.370621

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NN=C1[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1C(NN=C1[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C27H24N2P.BrH/c1-5-13-22(14-6-1)26-21-27(29-28-26)30(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25;/h1-20,26,28H,21H2;1H/q+1;/p-1