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

Systemtic Name: 4-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)butyl-triphenyl-phosphanium iodide Openeye Name: 4-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)butyl-triphenyl-phosphonium iodide CAS Name: 4-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)butyl-triphenylphosphonium iodide IUPAC Name: 4-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)butyl-triphenylphosphanium iodide Traditional Name: 4-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)butyl-triphenyl-phosphonium iodide Formula: C28H32IO3P MolecularWeight: 574.430111

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H32O3P.HI/c1-27-21-29-28(30-22-27,31-23-27)19-11-12-20-32(24-13-5-2-6-14-24,25-15-7-3-8-16-25)26-17-9-4-10-18-26;/h2-10,13-18H,11-12,19-23H2,1H3;1H/q+1;/p-1