N-[9-[(3aR,4R,6R,6aR)-6-[4-[tert-butyl(diphenyl)silyl]oxy-2-methanoyl-butyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-yl]benzamide

Systemtic Name: N-[9-[(3aR,4R,6R,6aR)-6-[4-[tert-butyl(diphenyl)silyl]oxy-2-methanoyl-butyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-yl]benzamide Openeye Name: N-[9-[(3aR,4R,6R,6aR)-6-[4-[tert-butyl(diphenyl)silyl]oxy-2-formyl-butyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-yl]benzamide CAS Name: N-[9-[(3aR,4R,6R,6aR)-6-[4-[tert-butyl(diphenyl)silyl]oxy-2-formylbutyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-6-purinyl]benzamide IUPAC Name: N-[9-[(3aR,4R,6R,6aR)-6-[4-[tert-butyl(diphenyl)silyl]oxy-2-formylbutyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-yl]benzamide Traditional Name: N-[9-[(3aR,4R,6R,6aR)-6-[4-[tert-butyl(diphenyl)silyl]oxy-2-formyl-butyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-yl]benzamide Formula: C40H45N5O6Si MolecularWeight: 719.9007

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C(OC(C2O1)N3C=NC4=C3N=CN=C4NC(=O)C5=CC=CC=C5)CC(CCO[Si](C6=CC=CC=C6)(C7=CC=CC=C7)C(C)(C)C)C=O)C

Isomeric SMILES

CC1(O[C@@H]2[C@H](O[C@H]([C@@H]2O1)N3C=NC4=C3N=CN=C4NC(=O)C5=CC=CC=C5)CC(CCO[Si](C6=CC=CC=C6)(C7=CC=CC=C7)C(C)(C)C)C=O)C

InChI

InChI=1S/C40H45N5O6Si/c1-39(2,3)52(29-17-11-7-12-18-29,30-19-13-8-14-20-30)48-22-21-27(24-46)23-31-33-34(51-40(4,5)50-33)38(49-31)45-26-43-32-35(41-25-42-36(32)45)44-37(47)28-15-9-6-10-16-28/h6-20,24-27,31,33-34,38H,21-23H2,1-5H3,(H,41,42,44,47)/t27?,31-,33-,34-,38-/m1/s1