[5-(6-aminopurin-9-yl)-2-cyano-oxolan-2-yl]methyl ethanoate

Systemtic Name: [5-(6-aminopurin-9-yl)-2-cyano-oxolan-2-yl]methyl ethanoate Openeye Name: [5-(6-aminopurin-9-yl)-2-cyano-tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [5-(6-aminopurin-9-yl)-2-cyano-2-oxolanyl]methyl ester IUPAC Name: [5-(6-aminopurin-9-yl)-2-cyanooxolan-2-yl]methyl acetate Traditional Name: acetic acid (5-adenin-9-yl-2-cyano-tetrahydrofuran-2-yl)methyl ester Formula: C13H14N6O3 MolecularWeight: 302.28866

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1(CCC(O1)N2C=NC3=C2N=CN=C3N)C#N

Isomeric SMILES

CC(=O)OCC1(CCC(O1)N2C=NC3=C2N=CN=C3N)C#N

InChI

InChI=1S/C13H14N6O3/c1-8(20)21-5-13(4-14)3-2-9(22-13)19-7-18-10-11(15)16-6-17-12(10)19/h6-7,9H,2-3,5H2,1H3,(H2,15,16,17)