2-[6-(oxan-4-ylamino)purin-9-yl]-5-(trifluoromethyloxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-(oxan-4-ylamino)purin-9-yl]-5-(trifluoromethyloxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-(tetrahydropyran-4-ylamino)purin-9-yl]-5-(trifluoromethoxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-(4-oxanylamino)-9-purinyl]-5-(trifluoromethoxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-(oxan-4-ylamino)purin-9-yl]-5-(trifluoromethoxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-(tetrahydropyran-4-ylamino)purin-9-yl]-5-(trifluoromethoxymethyl)tetrahydrofuran-3,4-diol Formula: C16H20F3N5O5 MolecularWeight: 419.35571

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NC2=NC=NC3=C2N=CN3C4C(C(C(O4)COC(F)(F)F)O)O

Isomeric SMILES

C1COCCC1NC2=NC=NC3=C2N=CN3C4C(C(C(O4)COC(F)(F)F)O)O

InChI

InChI=1S/C16H20F3N5O5/c17-16(18,19)28-5-9-11(25)12(26)15(29-9)24-7-22-10-13(20-6-21-14(10)24)23-8-1-3-27-4-2-8/h6-9,11-12,15,25-26H,1-5H2,(H,20,21,23)