(3,5-dimethylphenyl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (3,5-dimethylphenyl)methyl-triphenyl-phosphanium bromide Openeye Name: (3,5-dimethylphenyl)methyl-triphenyl-phosphonium bromide CAS Name: (3,5-dimethylphenyl)methyl-triphenylphosphonium bromide IUPAC Name: (3,5-dimethylphenyl)methyl-triphenylphosphanium bromide Traditional Name: (3,5-dimethylbenzyl)-triphenyl-phosphonium bromide Formula: C27H26BrP MolecularWeight: 461.373101

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C.[Br-]

Isomeric SMILES

CC1=CC(=CC(=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C.[Br-]

InChI

InChI=1S/C27H26P.BrH/c1-22-18-23(2)20-24(19-22)21-28(25-12-6-3-7-13-25,26-14-8-4-9-15-26)27-16-10-5-11-17-27;/h3-20H,21H2,1-2H3;1H/q+1;/p-1