[(3Z,6Z,9Z)-pentadeca-3,6,9-trienyl]-triphenyl-phosphanium bromide

Systemtic Name: [(3Z,6Z,9Z)-pentadeca-3,6,9-trienyl]-triphenyl-phosphanium bromide Openeye Name: [(3Z,6Z,9Z)-pentadeca-3,6,9-trienyl]-triphenyl-phosphonium bromide CAS Name: [(3Z,6Z,9Z)-pentadeca-3,6,9-trienyl]-triphenylphosphonium bromide IUPAC Name: [(3Z,6Z,9Z)-pentadeca-3,6,9-trienyl]-triphenylphosphanium bromide Traditional Name: [(3Z,6Z,9Z)-pentadeca-3,6,9-trienyl]-triphenyl-phosphonium bromide Formula: C33H40BrP MolecularWeight: 547.548461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCC=CCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CCCCC/C=C\C/C=C\C/C=C\CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C33H40P.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-13-23-30-34(31-24-17-14-18-25-31,32-26-19-15-20-27-32)33-28-21-16-22-29-33;/h6-7,9-10,12-22,24-29H,2-5,8,11,23,30H2,1H3;1H/q+1;/p-1/b7-6-,10-9-,13-12-;