[3-[5-[2-[2-(3-methanoylphenoxy)-5-methoxy-phenyl]ethyl]-2-methoxy-phenyl]-4-methoxy-phenyl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [3-[5-[2-[2-(3-methanoylphenoxy)-5-methoxy-phenyl]ethyl]-2-methoxy-phenyl]-4-methoxy-phenyl]methyl-triphenyl-phosphanium bromide Openeye Name: [3-[5-[2-[2-(3-formylphenoxy)-5-methoxy-phenyl]ethyl]-2-methoxy-phenyl]-4-methoxy-phenyl]methyl-triphenyl-phosphonium bromide CAS Name: [3-[5-[2-[2-(3-formylphenoxy)-5-methoxyphenyl]ethyl]-2-methoxyphenyl]-4-methoxyphenyl]methyl-triphenylphosphonium bromide IUPAC Name: [3-[5-[2-[2-(3-formylphenoxy)-5-methoxyphenyl]ethyl]-2-methoxyphenyl]-4-methoxyphenyl]methyl-triphenylphosphanium bromide Traditional Name: [3-[5-[2-[2-(3-formylphenoxy)-5-methoxy-phenyl]ethyl]-2-methoxy-phenyl]-4-methoxy-benzyl]-triphenyl-phosphonium bromide Formula: C49H44BrO5P MolecularWeight: 823.748421

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC2=CC=CC(=C2)C=O)CCC3=CC(=C(C=C3)OC)C4=C(C=CC(=C4)C[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)OC.[Br-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC2=CC=CC(=C2)C=O)CCC3=CC(=C(C=C3)OC)C4=C(C=CC(=C4)C[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)OC.[Br-]

InChI

InChI=1S/C49H44O5P.BrH/c1-51-40-26-29-47(54-41-15-13-14-37(30-41)34-50)39(33-40)25-22-36-23-27-48(52-2)45(31-36)46-32-38(24-28-49(46)53-3)35-55(42-16-7-4-8-17-42,43-18-9-5-10-19-43)44-20-11-6-12-21-44;/h4-21,23-24,26-34H,22,25,35H2,1-3H3;1H/q+1;/p-1