(4-fluoranyl-3-phenoxy-phenyl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (4-fluoranyl-3-phenoxy-phenyl)methyl-triphenyl-phosphanium bromide Openeye Name: (4-fluoro-3-phenoxy-phenyl)methyl-triphenyl-phosphonium bromide CAS Name: (4-fluoro-3-phenoxyphenyl)methyl-triphenylphosphonium bromide IUPAC Name: (4-fluoro-3-phenoxyphenyl)methyl-triphenylphosphanium bromide Traditional Name: (4-fluoro-3-phenoxy-benzyl)-triphenyl-phosphonium bromide Formula: C31H25BrFOP MolecularWeight: 543.405764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=CC(=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)F.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=CC(=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)F.[Br-]

InChI

InChI=1S/C31H25FOP.BrH/c32-30-22-21-25(23-31(30)33-26-13-5-1-6-14-26)24-34(27-15-7-2-8-16-27,28-17-9-3-10-18-28)29-19-11-4-12-20-29;/h1-23H,24H2;1H/q+1;/p-1