2-[[(6aR,8R,9R,9aR)-8-[2-azanyl-6-(2-nitrophenoxy)purin-9-yl]-2,2,4,4-tetra(propan-2-yl)-6a,8,9,9a-tetrahydro-6H-furo[3,2-f][1,3,5,2,4]trioxadisilocin-9-yl]oxy]ethanenitrile

Systemtic Name: 2-[[(6aR,8R,9R,9aR)-8-[2-azanyl-6-(2-nitrophenoxy)purin-9-yl]-2,2,4,4-tetra(propan-2-yl)-6a,8,9,9a-tetrahydro-6H-furo[3,2-f][1,3,5,2,4]trioxadisilocin-9-yl]oxy]ethanenitrile Openeye Name: 2-[[(6aR,8R,9R,9aR)-8-[2-amino-6-(2-nitrophenoxy)purin-9-yl]-2,2,4,4-tetraisopropyl-6a,8,9,9a-tetrahydro-6H-furo[3,2-f][1,3,5,2,4]trioxadisilocin-9-yl]oxy]acetonitrile CAS Name: 2-[[(6aR,8R,9R,9aR)-8-[2-amino-6-(2-nitrophenoxy)-9-purinyl]-2,2,4,4-tetra(propan-2-yl)-6a,8,9,9a-tetrahydro-6H-furo[3,2-f][1,3,5,2,4]trioxadisilocin-9-yl]oxy]acetonitrile IUPAC Name: 2-[[(6aR,8R,9R,9aR)-8-[2-amino-6-(2-nitrophenoxy)purin-9-yl]-2,2,4,4-tetra(propan-2-yl)-6a,8,9,9a-tetrahydro-6H-furo[3,2-f][1,3,5,2,4]trioxadisilocin-9-yl]oxy]acetonitrile Traditional Name: 2-[[(6aR,8R,9R,9aR)-8-[2-amino-6-(2-nitrophenoxy)purin-9-yl]-2,2,4,4-tetraisopropyl-6a,8,9,9a-tetrahydro-6H-furo[3,2-f][1,3,5,2,4]trioxadisilocin-9-yl]oxy]acetonitrile Formula: C30H43N7O8Si2 MolecularWeight: 685.87552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[Si]1(OCC2C(C(C(O2)N3C=NC4=C3N=C(N=C4OC5=CC=CC=C5[N+](=O)[O-])N)OCC#N)O[Si](O1)(C(C)C)C(C)C)C(C)C

Isomeric SMILES

CC(C)[Si]1(OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C3N=C(N=C4OC5=CC=CC=C5[N+](=O)[O-])N)OCC#N)O[Si](O1)(C(C)C)C(C)C)C(C)C

InChI

InChI=1S/C30H43N7O8Si2/c1-17(2)46(18(3)4)41-15-23-25(44-47(45-46,19(5)6)20(7)8)26(40-14-13-31)29(43-23)36-16-33-24-27(36)34-30(32)35-28(24)42-22-12-10-9-11-21(22)37(38)39/h9-12,16-20,23,25-26,29H,14-15H2,1-8H3,(H2,32,34,35)/t23-,25-,26-,29-/m1/s1