[(3S)-3,7-dimethyloctyl]-triphenyl-phosphanium bromide

Systemtic Name: [(3S)-3,7-dimethyloctyl]-triphenyl-phosphanium bromide Openeye Name: [(3S)-3,7-dimethyloctyl]-triphenyl-phosphonium bromide CAS Name: [(3S)-3,7-dimethyloctyl]-triphenylphosphonium bromide IUPAC Name: [(3S)-3,7-dimethyloctyl]-triphenylphosphanium bromide Traditional Name: [(3S)-3,7-dimethyloctyl]-triphenyl-phosphonium bromide Formula: C28H36BrP MolecularWeight: 483.463201

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H36P.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;/h4-12,16-21,24-25H,13-15,22-23H2,1-3H3;1H/q+1;/p-1/t25-;/m0./s1