[3-(2-methanoylphenoxy)-2-oxidanyl-propyl]-triphenyl-phosphanium bromide

Systemtic Name: [3-(2-methanoylphenoxy)-2-oxidanyl-propyl]-triphenyl-phosphanium bromide Openeye Name: [3-(2-formylphenoxy)-2-hydroxy-propyl]-triphenyl-phosphonium bromide CAS Name: [3-(2-formylphenoxy)-2-hydroxypropyl]-triphenylphosphonium bromide IUPAC Name: [3-(2-formylphenoxy)-2-hydroxypropyl]-triphenylphosphanium bromide Traditional Name: [3-(2-formylphenoxy)-2-hydroxy-propyl]-triphenyl-phosphonium bromide Formula: C28H26BrO3P MolecularWeight: 521.382001

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC(COC2=CC=CC=C2C=O)O)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC(COC2=CC=CC=C2C=O)O)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C28H26O3P.BrH/c29-20-23-12-10-11-19-28(23)31-21-24(30)22-32(25-13-4-1-5-14-25,26-15-6-2-7-16-26)27-17-8-3-9-18-27;/h1-20,24,30H,21-22H2;1H/q+1;/p-1