[(5R,7S)-5,7-dimethylundecyl]-triphenyl-phosphanium bromide

Systemtic Name: [(5R,7S)-5,7-dimethylundecyl]-triphenyl-phosphanium bromide Openeye Name: [(5R,7S)-5,7-dimethylundecyl]-triphenyl-phosphonium bromide CAS Name: [(5R,7S)-5,7-dimethylundecyl]-triphenylphosphonium bromide IUPAC Name: [(5R,7S)-5,7-dimethylundecyl]-triphenylphosphanium bromide Traditional Name: [(5R,7S)-5,7-dimethylundecyl]-triphenyl-phosphonium bromide Formula: C31H42BrP MolecularWeight: 525.542941

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H42P.BrH/c1-4-5-17-27(2)26-28(3)18-15-16-25-32(29-19-9-6-10-20-29,30-21-11-7-12-22-30)31-23-13-8-14-24-31;/h6-14,19-24,27-28H,4-5,15-18,25-26H2,1-3H3;1H/q+1;/p-1/t27-,28+;/m0./s1