3-(oxan-2-yloxy)propyl-triphenyl-phosphanium bromide

Systemtic Name: 3-(oxan-2-yloxy)propyl-triphenyl-phosphanium bromide Openeye Name: triphenyl(3-tetrahydropyran-2-yloxypropyl)phosphonium bromide CAS Name: 3-(2-oxanyloxy)propyl-triphenylphosphonium bromide IUPAC Name: 3-(oxan-2-yloxy)propyl-triphenylphosphanium bromide Traditional Name: triphenyl(3-tetrahydropyran-2-yloxypropyl)phosphonium bromide Formula: C26H30BrO2P MolecularWeight: 485.392961

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1CCOC(C1)OCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C26H30O2P.BrH/c1-4-13-23(14-5-1)29(24-15-6-2-7-16-24,25-17-8-3-9-18-25)22-12-21-28-26-19-10-11-20-27-26;/h1-9,13-18,26H,10-12,19-22H2;1H/q+1;/p-1