2-(iodanylmethyl)-6-methoxy-3,4,5-tris-(triphenylmethyl)oxy-oxane

Systemtic Name: 2-(iodanylmethyl)-6-methoxy-3,4,5-tris-(triphenylmethyl)oxy-oxane Openeye Name: 2-(iodomethyl)-6-methoxy-3,4,5-tritrityloxy-tetrahydropyran CAS Name: 2-(iodomethyl)-6-methoxy-3,4,5-tris-(triphenylmethyl)oxyoxane IUPAC Name: 2-(iodomethyl)-6-methoxy-3,4,5-tritrityloxyoxane Traditional Name: 2-(iodomethyl)-6-methoxy-3,4,5-tritrityloxy-tetrahydropyran Formula: C64H55IO5 MolecularWeight: 1031.02297

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C(C(O1)CI)OC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)OC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)OC(C8=CC=CC=C8)(C9=CC=CC=C9)C1=CC=CC=C1

Isomeric SMILES

COC1C(C(C(C(O1)CI)OC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)OC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)OC(C8=CC=CC=C8)(C9=CC=CC=C9)C1=CC=CC=C1

InChI

InChI=1S/C64H55IO5/c1-66-61-60(70-64(54-41-23-8-24-42-54,55-43-25-9-26-44-55)56-45-27-10-28-46-56)59(69-63(51-35-17-5-18-36-51,52-37-19-6-20-38-52)53-39-21-7-22-40-53)58(57(47-65)67-61)68-62(48-29-11-2-12-30-48,49-31-13-3-14-32-49)50-33-15-4-16-34-50/h2-46,57-61H,47H2,1H3