2-[6-chloranyl-2-(trifluoromethyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-chloranyl-2-(trifluoromethyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-chloro-2-(trifluoromethyl)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-chloro-2-(trifluoromethyl)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-chloro-2-(trifluoromethyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-chloro-2-(trifluoromethyl)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C11H10ClF3N4O4 MolecularWeight: 354.66971

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=C(N=C2Cl)C(F)(F)F

Isomeric SMILES

C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=C(N=C2Cl)C(F)(F)F

InChI

InChI=1S/C11H10ClF3N4O4/c12-7-4-8(18-10(17-7)11(13,14)15)19(2-16-4)9-6(22)5(21)3(1-20)23-9/h2-3,5-6,9,20-22H,1H2