[4-[4-(methylcarbamoyl)phenyl]phenyl]-triphenyl-phosphanium bromide

Systemtic Name: [4-[4-(methylcarbamoyl)phenyl]phenyl]-triphenyl-phosphanium bromide Openeye Name: [4-[4-(methylcarbamoyl)phenyl]phenyl]-triphenyl-phosphonium bromide CAS Name: [4-[4-(methylcarbamoyl)phenyl]phenyl]-triphenylphosphonium bromide IUPAC Name: [4-[4-(methylcarbamoyl)phenyl]phenyl]-triphenylphosphanium bromide Traditional Name: [4-[4-(methylcarbamoyl)phenyl]phenyl]-triphenyl-phosphonium bromide Formula: C32H27BrNOP MolecularWeight: 552.440641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H26NOP.BrH/c1-33-32(34)27-19-17-25(18-20-27)26-21-23-31(24-22-26)35(28-11-5-2-6-12-28,29-13-7-3-8-14-29)30-15-9-4-10-16-30;/h2-24H,1H3;1H