(4-methoxycarbonyl-3-phenyl-phenyl)-diphenyl-(phenylmethyl)phosphanium bromide

Systemtic Name: (4-methoxycarbonyl-3-phenyl-phenyl)-diphenyl-(phenylmethyl)phosphanium bromide Openeye Name: benzyl-(4-methoxycarbonyl-3-phenyl-phenyl)-diphenyl-phosphonium bromide CAS Name: (4-methoxycarbonyl-3-phenylphenyl)-diphenyl-(phenylmethyl)phosphonium bromide IUPAC Name: benzyl-(4-methoxycarbonyl-3-phenylphenyl)-diphenylphosphanium bromide Traditional Name: benzyl-(4-carbomethoxy-3-phenyl-phenyl)-diphenyl-phosphonium bromide Formula: C33H28BrO2P MolecularWeight: 567.451981

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)[P+](CC2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)[P+](CC2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C33H28O2P.BrH/c1-35-33(34)31-23-22-30(24-32(31)27-16-8-3-9-17-27)36(28-18-10-4-11-19-28,29-20-12-5-13-21-29)25-26-14-6-2-7-15-26;/h2-24H,25H2,1H3;1H/q+1;/p-1