6-chloranyl-9-[3-fluoranyl-4-(triphenylmethyl)oxy-5-[(triphenylmethyl)oxymethyl]oxolan-2-yl]purine

Systemtic Name: 6-chloranyl-9-[3-fluoranyl-4-(triphenylmethyl)oxy-5-[(triphenylmethyl)oxymethyl]oxolan-2-yl]purine Openeye Name: 6-chloro-9-[3-fluoro-4-trityloxy-5-(trityloxymethyl)tetrahydrofuran-2-yl]purine CAS Name: 6-chloro-9-[3-fluoro-4-(triphenylmethyl)oxy-5-[(triphenylmethyl)oxymethyl]-2-oxolanyl]purine IUPAC Name: 6-chloro-9-[3-fluoro-4-trityloxy-5-(trityloxymethyl)oxolan-2-yl]purine Traditional Name: 6-chloro-9-[3-fluoro-4-trityloxy-5-(trityloxymethyl)tetrahydrofuran-2-yl]purine Formula: C48H38ClFN4O3 MolecularWeight: 773.291723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCC4C(C(C(O4)N5C=NC6=C5N=CN=C6Cl)F)OC(C7=CC=CC=C7)(C8=CC=CC=C8)C9=CC=CC=C9

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCC4C(C(C(O4)N5C=NC6=C5N=CN=C6Cl)F)OC(C7=CC=CC=C7)(C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChI=1S/C48H38ClFN4O3/c49-44-42-45(52-32-51-44)54(33-53-42)46-41(50)43(57-48(37-25-13-4-14-26-37,38-27-15-5-16-28-38)39-29-17-6-18-30-39)40(56-46)31-55-47(34-19-7-1-8-20-34,35-21-9-2-10-22-35)36-23-11-3-12-24-36/h1-30,32-33,40-41,43,46H,31H2