(3,5-ditert-butyl-4-methoxy-phenyl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (3,5-ditert-butyl-4-methoxy-phenyl)methyl-triphenyl-phosphanium bromide Openeye Name: (3,5-ditert-butyl-4-methoxy-phenyl)methyl-triphenyl-phosphonium bromide CAS Name: (3,5-ditert-butyl-4-methoxyphenyl)methyl-triphenylphosphonium bromide IUPAC Name: (3,5-ditert-butyl-4-methoxyphenyl)methyl-triphenylphosphanium bromide Traditional Name: (3,5-ditert-butyl-4-methoxy-benzyl)-triphenyl-phosphonium bromide Formula: C34H40BrOP MolecularWeight: 575.558561

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C34H40OP.BrH/c1-33(2,3)30-23-26(24-31(32(30)35-7)34(4,5)6)25-36(27-17-11-8-12-18-27,28-19-13-9-14-20-28)29-21-15-10-16-22-29;/h8-24H,25H2,1-7H3;1H/q+1;/p-1