(3-phenoxyphenyl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (3-phenoxyphenyl)methyl-triphenyl-phosphanium bromide Openeye Name: (3-phenoxyphenyl)methyl-triphenyl-phosphonium bromide CAS Name: (3-phenoxyphenyl)methyl-triphenylphosphonium bromide IUPAC Name: (3-phenoxyphenyl)methyl-triphenylphosphanium bromide Traditional Name: (3-phenoxybenzyl)-triphenyl-phosphonium bromide Formula: C31H26BrOP MolecularWeight: 525.415301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H26OP.BrH/c1-5-15-27(16-6-1)32-28-17-13-14-26(24-28)25-33(29-18-7-2-8-19-29,30-20-9-3-10-21-30)31-22-11-4-12-23-31;/h1-24H,25H2;1H/q+1;/p-1