(4-methoxy-1-benzofuran-6-yl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (4-methoxy-1-benzofuran-6-yl)methyl-triphenyl-phosphanium bromide Openeye Name: (4-methoxybenzofuran-6-yl)methyl-triphenyl-phosphonium bromide CAS Name: (4-methoxy-6-benzofuranyl)methyl-triphenylphosphonium bromide IUPAC Name: (4-methoxy-1-benzofuran-6-yl)methyl-triphenylphosphanium bromide Traditional Name: (4-methoxybenzofuran-6-yl)methyl-triphenyl-phosphonium bromide Formula: C28H24BrO2P MolecularWeight: 503.366721

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1C=CO2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

COC1=CC(=CC2=C1C=CO2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C28H24O2P.BrH/c1-29-27-19-22(20-28-26(27)17-18-30-28)21-31(23-11-5-2-6-12-23,24-13-7-3-8-14-24)25-15-9-4-10-16-25;/h2-20H,21H2,1H3;1H/q+1;/p-1