[(2S,5S)-5-(2,6-diacetamidopurin-9-yl)oxan-2-yl]methyl ethanoate

Systemtic Name: [(2S,5S)-5-(2,6-diacetamidopurin-9-yl)oxan-2-yl]methyl ethanoate Openeye Name: [(2S,5S)-5-(2,6-diacetamidopurin-9-yl)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2S,5S)-5-(2,6-diacetamido-9-purinyl)-2-oxanyl]methyl ester IUPAC Name: [(2S,5S)-5-(2,6-diacetamidopurin-9-yl)oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2S,5S)-5-(2,6-diacetamidopurin-9-yl)tetrahydropyran-2-yl]methyl ester Formula: C17H22N6O5 MolecularWeight: 390.39378

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=NC2=C1N=CN2C3CCC(OC3)COC(=O)C)NC(=O)C

Isomeric SMILES

CC(=O)NC1=NC(=NC2=C1N=CN2[C@H]3CC[C@H](OC3)COC(=O)C)NC(=O)C

InChI

InChI=1S/C17H22N6O5/c1-9(24)19-15-14-16(22-17(21-15)20-10(2)25)23(8-18-14)12-4-5-13(28-6-12)7-27-11(3)26/h8,12-13H,4-7H2,1-3H3,(H2,19,20,21,22,24,25)/t12-,13-/m0/s1