[(2E)-3,7-dimethylocta-2,6-dienyl]-triphenyl-phosphanium bromide

Systemtic Name: [(2E)-3,7-dimethylocta-2,6-dienyl]-triphenyl-phosphanium bromide Openeye Name: [(2E)-3,7-dimethylocta-2,6-dienyl]-triphenyl-phosphonium bromide CAS Name: [(2E)-3,7-dimethylocta-2,6-dienyl]-triphenylphosphonium bromide IUPAC Name: [(2E)-3,7-dimethylocta-2,6-dienyl]-triphenylphosphanium bromide Traditional Name: [(2E)-3,7-dimethylocta-2,6-dienyl]-triphenyl-phosphonium bromide Formula: C28H32BrP MolecularWeight: 479.431441

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C)C.[Br-]

Isomeric SMILES

CC(=CCC/C(=C/C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)/C)C.[Br-]

InChI

InChI=1S/C28H32P.BrH/c1-24(2)14-13-15-25(3)22-23-29(26-16-7-4-8-17-26,27-18-9-5-10-19-27)28-20-11-6-12-21-28;/h4-12,14,16-22H,13,15,23H2,1-3H3;1H/q+1;/p-1/b25-22+;