3-[6-(4-fluorophenyl)purin-9-yl]propane-1,2-diol

Systemtic Name: 3-[6-(4-fluorophenyl)purin-9-yl]propane-1,2-diol Openeye Name: 3-[6-(4-fluorophenyl)purin-9-yl]propane-1,2-diol CAS Name: 3-[6-(4-fluorophenyl)-9-purinyl]propane-1,2-diol IUPAC Name: 3-[6-(4-fluorophenyl)purin-9-yl]propane-1,2-diol Traditional Name: 3-[6-(4-fluorophenyl)purin-9-yl]propane-1,2-diol Formula: C14H13FN4O2 MolecularWeight: 288.277023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C(=NC=N2)N(C=N3)CC(CO)O)F

Isomeric SMILES

C1=CC(=CC=C1C2=C3C(=NC=N2)N(C=N3)CC(CO)O)F

InChI

InChI=1S/C14H13FN4O2/c15-10-3-1-9(2-4-10)12-13-14(17-7-16-12)19(8-18-13)5-11(21)6-20/h1-4,7-8,11,20-21H,5-6H2