3-(2-methanoylphenoxy)propyl-triphenyl-phosphanium bromide

Systemtic Name: 3-(2-methanoylphenoxy)propyl-triphenyl-phosphanium bromide Openeye Name: 3-(2-formylphenoxy)propyl-triphenyl-phosphonium bromide CAS Name: 3-(2-formylphenoxy)propyl-triphenylphosphonium bromide IUPAC Name: 3-(2-formylphenoxy)propyl-triphenylphosphanium bromide Traditional Name: 3-(2-formylphenoxy)propyl-triphenyl-phosphonium bromide Formula: C28H26BrO2P MolecularWeight: 505.382601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CCCOC2=CC=CC=C2C=O)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CCCOC2=CC=CC=C2C=O)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C28H26O2P.BrH/c29-23-24-13-10-11-20-28(24)30-21-12-22-31(25-14-4-1-5-15-25,26-16-6-2-7-17-26)27-18-8-3-9-19-27;/h1-11,13-20,23H,12,21-22H2;1H/q+1;/p-1