14-(oxan-2-yloxy)tetradecyl-triphenyl-phosphanium iodide

Systemtic Name: 14-(oxan-2-yloxy)tetradecyl-triphenyl-phosphanium iodide Openeye Name: triphenyl(14-tetrahydropyran-2-yloxytetradecyl)phosphonium iodide CAS Name: 14-(2-oxanyloxy)tetradecyl-triphenylphosphonium iodide IUPAC Name: 14-(oxan-2-yloxy)tetradecyl-triphenylphosphanium iodide Traditional Name: triphenyl(14-tetrahydropyran-2-yloxytetradecyl)phosphonium iodide Formula: C37H52IO2P MolecularWeight: 686.685811

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCCCCCCCCCCCCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

Isomeric SMILES

C1CCOC(C1)OCCCCCCCCCCCCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

InChI

InChI=1S/C37H52O2P.HI/c1(3-5-7-9-21-31-38-37-30-20-22-32-39-37)2-4-6-8-10-23-33-40(34-24-14-11-15-25-34,35-26-16-12-17-27-35)36-28-18-13-19-29-36;/h11-19,24-29,37H,1-10,20-23,30-33H2;1H/q+1;/p-1