[(4E,6E,10R)-10-methoxy-7-methyl-trideca-4,6,12-trienyl]-triphenyl-phosphanium iodide

Systemtic Name: [(4E,6E,10R)-10-methoxy-7-methyl-trideca-4,6,12-trienyl]-triphenyl-phosphanium iodide Openeye Name: [(4E,6E,10R)-10-methoxy-7-methyl-trideca-4,6,12-trienyl]-triphenyl-phosphonium iodide CAS Name: [(4E,6E,10R)-10-methoxy-7-methyltrideca-4,6,12-trienyl]-triphenylphosphonium iodide IUPAC Name: [(4E,6E,10R)-10-methoxy-7-methyltrideca-4,6,12-trienyl]-triphenylphosphanium iodide Traditional Name: [(4E,6E,10R)-10-methoxy-7-methyl-trideca-4,6,12-trienyl]-triphenyl-phosphonium iodide Formula: C33H40IOP MolecularWeight: 610.548331

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC=CCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)CCC(CC=C)OC.[I-]

Isomeric SMILES

C/C(=C\C=C\CCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)/CC[C@H](CC=C)OC.[I-]

InChI

InChI=1S/C33H40OP.HI/c1-4-18-30(34-3)27-26-29(2)19-10-5-6-17-28-35(31-20-11-7-12-21-31,32-22-13-8-14-23-32)33-24-15-9-16-25-33;/h4-5,7-16,19-25,30H,1,6,17-18,26-28H2,2-3H3;1H/q+1;/p-1/b10-5+,29-19+;/t30-;/m0./s1