[(2S,5S)-5-(2-acetamido-6-azanyl-purin-9-yl)oxan-2-yl]methyl ethanoate

Systemtic Name: [(2S,5S)-5-(2-acetamido-6-azanyl-purin-9-yl)oxan-2-yl]methyl ethanoate Openeye Name: [(2S,5S)-5-(2-acetamido-6-amino-purin-9-yl)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2S,5S)-5-(2-acetamido-6-amino-9-purinyl)-2-oxanyl]methyl ester IUPAC Name: [(2S,5S)-5-(2-acetamido-6-aminopurin-9-yl)oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2S,5S)-5-(2-acetamido-6-amino-purin-9-yl)tetrahydropyran-2-yl]methyl ester Formula: C15H20N6O4 MolecularWeight: 348.3571

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(C(=N1)N)N=CN2C3CCC(OC3)COC(=O)C

Isomeric SMILES

CC(=O)NC1=NC2=C(C(=N1)N)N=CN2[C@H]3CC[C@H](OC3)COC(=O)C

InChI

InChI=1S/C15H20N6O4/c1-8(22)18-15-19-13(16)12-14(20-15)21(7-17-12)10-3-4-11(25-5-10)6-24-9(2)23/h7,10-11H,3-6H2,1-2H3,(H3,16,18,19,20,22)/t10-,11-/m0/s1