[2-(2-bromoethyl)phenyl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [2-(2-bromoethyl)phenyl]methyl-triphenyl-phosphanium bromide Openeye Name: [2-(2-bromoethyl)phenyl]methyl-triphenyl-phosphonium bromide CAS Name: [2-(2-bromoethyl)phenyl]methyl-triphenylphosphonium bromide IUPAC Name: [2-(2-bromoethyl)phenyl]methyl-triphenylphosphanium bromide Traditional Name: [2-(2-bromoethyl)benzyl]-triphenyl-phosphonium bromide Formula: C27H25Br2P MolecularWeight: 540.269161

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=CC=CC=C2CCBr)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=CC=CC=C2CCBr)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C27H25BrP.BrH/c28-21-20-23-12-10-11-13-24(23)22-29(25-14-4-1-5-15-25,26-16-6-2-7-17-26)27-18-8-3-9-19-27;/h1-19H,20-22H2;1H/q+1;/p-1