3-[(4R,5R)-2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-4-yl]propyl-triphenyl-phosphanium iodide

Systemtic Name: 3-[(4R,5R)-2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-4-yl]propyl-triphenyl-phosphanium iodide Openeye Name: 3-[(4R,5R)-2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-4-yl]propyl-triphenyl-phosphonium iodide CAS Name: 3-[(4R,5R)-2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-4-yl]propyl-triphenylphosphonium iodide IUPAC Name: 3-[(4R,5R)-2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-4-yl]propyl-triphenylphosphanium iodide Traditional Name: 3-[(4R,5R)-2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-4-yl]propyl-triphenyl-phosphonium iodide Formula: C33H36IO3P MolecularWeight: 638.515371

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Descriptors Computed from Structure

Canonical SMILES:

CC1COC(OC1CCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=C(C=C5)OC.[I-]

Isomeric SMILES

C[C@@H]1COC(O[C@@H]1CCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=C(C=C5)OC.[I-]

InChI

InChI=1S/C33H36O3P.HI/c1-26-25-35-33(27-20-22-28(34-2)23-21-27)36-32(26)19-12-24-37(29-13-6-3-7-14-29,30-15-8-4-9-16-30)31-17-10-5-11-18-31;/h3-11,13-18,20-23,26,32-33H,12,19,24-25H2,1-2H3;1H/q+1;/p-1/t26-,32-,33?;/m1./s1