2-(1,3-dihydroisoindol-2-yl)ethyl-triphenyl-phosphanium bromide hydrobromide

Systemtic Name: 2-(1,3-dihydroisoindol-2-yl)ethyl-triphenyl-phosphanium bromide hydrobromide Openeye Name: 2-isoindolin-2-ylethyl(triphenyl)phosphonium bromide hydrobromide CAS Name: 2-(1,3-dihydroisoindol-2-yl)ethyl-triphenylphosphonium bromide hydrobromide IUPAC Name: 2-(1,3-dihydroisoindol-2-yl)ethyl-triphenylphosphanium bromide hydrobromide Traditional Name: 2-isoindolin-2-ylethyl(triphenyl)phosphonium bromide hydrobromide Formula: C28H28Br2NP MolecularWeight: 569.310381

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2CN1CC[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.Br.[Br-]

Isomeric SMILES

C1C2=CC=CC=C2CN1CC[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.Br.[Br-]

InChI

InChI=1S/C28H27NP.2BrH/c1-4-14-26(15-5-1)30(27-16-6-2-7-17-27,28-18-8-3-9-19-28)21-20-29-22-24-12-10-11-13-25(24)23-29;;/h1-19H,20-23H2;2*1H/q+1;;/p-1