15-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)pentadecyl-triphenyl-phosphanium iodide

Systemtic Name: 15-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)pentadecyl-triphenyl-phosphanium iodide Openeye Name: 15-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)pentadecyl-triphenyl-phosphonium iodide CAS Name: 15-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)pentadecyl-triphenylphosphonium iodide IUPAC Name: 15-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)pentadecyl-triphenylphosphanium iodide Traditional Name: 15-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)pentadecyl-triphenyl-phosphonium iodide Formula: C39H54IO3P MolecularWeight: 728.722491

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Descriptors Computed from Structure

Canonical SMILES:

CC12COC(OC1)(OC2)CCCCCCCCCCCCCCC[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[I-]

Isomeric SMILES

CC12COC(OC1)(OC2)CCCCCCCCCCCCCCC[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[I-]

InChI

InChI=1S/C39H54O3P.HI/c1-38-32-40-39(41-33-38,42-34-38)30-22-11-9-7-5-3-2-4-6-8-10-12-23-31-43(35-24-16-13-17-25-35,36-26-18-14-19-27-36)37-28-20-15-21-29-37;/h13-21,24-29H,2-12,22-23,30-34H2,1H3;1H/q+1;/p-1