[4-(4-phenoxybutoxy)phenyl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [4-(4-phenoxybutoxy)phenyl]methyl-triphenyl-phosphanium bromide Openeye Name: [4-(4-phenoxybutoxy)phenyl]methyl-triphenyl-phosphonium bromide CAS Name: [4-(4-phenoxybutoxy)phenyl]methyl-triphenylphosphonium bromide IUPAC Name: [4-(4-phenoxybutoxy)phenyl]methyl-triphenylphosphanium bromide Traditional Name: [4-(4-phenoxybutoxy)benzyl]-triphenyl-phosphonium bromide Formula: C35H34BrO2P MolecularWeight: 597.521021

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCCOC2=CC=C(C=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)OCCCCOC2=CC=C(C=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C35H34O2P.BrH/c1-5-15-31(16-6-1)36-27-13-14-28-37-32-25-23-30(24-26-32)29-38(33-17-7-2-8-18-33,34-19-9-3-10-20-34)35-21-11-4-12-22-35;/h1-12,15-26H,13-14,27-29H2;1H/q+1;/p-1