(4-bromanyl-2-fluoranyl-phenyl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl-triphenyl-phosphanium bromide Openeye Name: (4-bromo-2-fluoro-phenyl)methyl-triphenyl-phosphonium bromide CAS Name: (4-bromo-2-fluorophenyl)methyl-triphenylphosphonium bromide IUPAC Name: (4-bromo-2-fluorophenyl)methyl-triphenylphosphanium bromide Traditional Name: (4-bromo-2-fluoro-benzyl)-triphenyl-phosphonium bromide Formula: C25H20Br2FP MolecularWeight: 530.206464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H20BrFP.BrH/c26-21-17-16-20(25(27)18-21)19-28(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24;/h1-18H,19H2;1H/q+1;/p-1