(2-acetamidophenyl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (2-acetamidophenyl)methyl-triphenyl-phosphanium bromide Openeye Name: (2-acetamidophenyl)methyl-triphenyl-phosphonium bromide CAS Name: (2-acetamidophenyl)methyl-triphenylphosphonium bromide IUPAC Name: (2-acetamidophenyl)methyl-triphenylphosphanium bromide Traditional Name: (2-acetamidobenzyl)-triphenyl-phosphonium bromide Formula: C27H25BrNOP MolecularWeight: 490.371261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CC(=O)NC1=CC=CC=C1C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C27H24NOP.BrH/c1-22(29)28-27-20-12-11-13-23(27)21-30(24-14-5-2-6-15-24,25-16-7-3-8-17-25)26-18-9-4-10-19-26;/h2-20H,21H2,1H3;1H