[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)phenyl]-hexyl-diphenyl-phosphanium bromide

Systemtic Name: [3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)phenyl]-hexyl-diphenyl-phosphanium bromide Openeye Name: [3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)phenyl]-hexyl-diphenyl-phosphonium bromide CAS Name: [3-(4-acetyl-3-hydroxy-2-propylphenoxy)phenyl]-hexyl-diphenylphosphonium bromide IUPAC Name: [3-(4-acetyl-3-hydroxy-2-propylphenoxy)phenyl]-hexyl-diphenylphosphanium bromide Traditional Name: [3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)phenyl]-hexyl-diphenyl-phosphonium bromide Formula: C35H40BrO3P MolecularWeight: 619.568061

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC(=C3)OC4=C(C(=C(C=C4)C(=O)C)O)CCC.[Br-]

Isomeric SMILES

CCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC(=C3)OC4=C(C(=C(C=C4)C(=O)C)O)CCC.[Br-]

InChI

InChI=1S/C35H39O3P.BrH/c1-4-6-7-14-25-39(29-18-10-8-11-19-29,30-20-12-9-13-21-30)31-22-15-17-28(26-31)38-34-24-23-32(27(3)36)35(37)33(34)16-5-2;/h8-13,15,17-24,26H,4-7,14,16,25H2,1-3H3;1H