[3-acetyloxy-5-(6-azanyl-2-fluoranyl-purin-9-yl)-2-cyano-oxolan-2-yl]methyl ethanoate

Systemtic Name: [3-acetyloxy-5-(6-azanyl-2-fluoranyl-purin-9-yl)-2-cyano-oxolan-2-yl]methyl ethanoate Openeye Name: [3-acetoxy-5-(6-amino-2-fluoro-purin-9-yl)-2-cyano-tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [3-acetyloxy-5-(6-amino-2-fluoro-9-purinyl)-2-cyano-2-oxolanyl]methyl ester IUPAC Name: [3-acetyloxy-5-(6-amino-2-fluoropurin-9-yl)-2-cyanooxolan-2-yl]methyl acetate Traditional Name: acetic acid [3-acetoxy-5-(6-amino-2-fluoro-purin-9-yl)-2-cyano-tetrahydrofuran-2-yl]methyl ester Formula: C15H15FN6O5 MolecularWeight: 378.315203

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1(C(CC(O1)N2C=NC3=C2N=C(N=C3N)F)OC(=O)C)C#N

Isomeric SMILES

CC(=O)OCC1(C(CC(O1)N2C=NC3=C2N=C(N=C3N)F)OC(=O)C)C#N

InChI

InChI=1S/C15H15FN6O5/c1-7(23)25-5-15(4-17)9(26-8(2)24)3-10(27-15)22-6-19-11-12(18)20-14(16)21-13(11)22/h6,9-10H,3,5H2,1-2H3,(H2,18,20,21)