1-benzofuran-2-ylmethyl(triphenyl)phosphanium bromide

Systemtic Name: 1-benzofuran-2-ylmethyl(triphenyl)phosphanium bromide Openeye Name: benzofuran-2-ylmethyl(triphenyl)phosphonium bromide CAS Name: 2-benzofuranylmethyl(triphenyl)phosphonium bromide IUPAC Name: 1-benzofuran-2-ylmethyl(triphenyl)phosphanium bromide Traditional Name: benzofuran-2-ylmethyl(triphenyl)phosphonium bromide Formula: C27H22BrOP MolecularWeight: 473.340741

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=CC3=CC=CC=C3O2)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=CC3=CC=CC=C3O2)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C27H22OP.BrH/c1-4-13-24(14-5-1)29(25-15-6-2-7-16-25,26-17-8-3-9-18-26)21-23-20-22-12-10-11-19-27(22)28-23;/h1-20H,21H2;1H/q+1;/p-1