2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl-triphenyl-phosphanium bromide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl-triphenyl-phosphanium bromide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl-triphenyl-phosphonium bromide CAS Name: 2-(1,3-dioxo-2-isoindolyl)ethyl-triphenylphosphonium bromide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl-triphenylphosphanium bromide Traditional Name: triphenyl(2-phthalimidoethyl)phosphonium bromide Formula: C28H23BrNO2P MolecularWeight: 516.365481

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CCN2C(=O)C3=CC=CC=C3C2=O)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CCN2C(=O)C3=CC=CC=C3C2=O)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C28H23NO2P.BrH/c30-27-25-18-10-11-19-26(25)28(31)29(27)20-21-32(22-12-4-1-5-13-22,23-14-6-2-7-15-23)24-16-8-3-9-17-24;/h1-19H,20-21H2;1H/q+1;/p-1