(4-chloranyl-2-phenylmethoxy-phenyl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (4-chloranyl-2-phenylmethoxy-phenyl)methyl-triphenyl-phosphanium bromide Openeye Name: (2-benzyloxy-4-chloro-phenyl)methyl-triphenyl-phosphonium bromide CAS Name: (4-chloro-2-phenylmethoxyphenyl)methyl-triphenylphosphonium bromide IUPAC Name: (4-chloro-2-phenylmethoxyphenyl)methyl-triphenylphosphanium bromide Traditional Name: (2-benzoxy-4-chloro-benzyl)-triphenyl-phosphonium bromide Formula: C32H27BrClOP MolecularWeight: 573.886941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=CC(=C2)Cl)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=CC(=C2)Cl)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C32H27ClOP.BrH/c33-28-22-21-27(32(23-28)34-24-26-13-5-1-6-14-26)25-35(29-15-7-2-8-16-29,30-17-9-3-10-18-30)31-19-11-4-12-20-31;/h1-23H,24-25H2;1H/q+1;/p-1