ethoxycarbonyl(triphenyl)phosphanium bromide

Systemtic Name: ethoxycarbonyl(triphenyl)phosphanium bromide Openeye Name: ethoxycarbonyl(triphenyl)phosphonium bromide CAS Name: ethoxycarbonyl(triphenyl)phosphonium bromide IUPAC Name: ethoxycarbonyl(triphenyl)phosphanium bromide Traditional Name: carbethoxy(triphenyl)phosphonium bromide Formula: C21H20BrO2P MolecularWeight: 415.260061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CCOC(=O)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C21H20O2P.BrH/c1-2-23-21(22)24(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20;/h3-17H,2H2,1H3;1H/q+1;/p-1