[4-acetyloxy-2-(azidomethyl)-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-3-yl] ethanoate

Systemtic Name: [4-acetyloxy-2-(azidomethyl)-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-3-yl] ethanoate Openeye Name: [4-acetoxy-2-(azidomethyl)-5-(6-oxo-3H-purin-9-yl)tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [4-acetyloxy-2-(azidomethyl)-5-(6-oxo-3H-purin-9-yl)-3-oxolanyl] ester IUPAC Name: [4-acetyloxy-2-(azidomethyl)-5-(6-oxo-3H-purin-9-yl)oxolan-3-yl] acetate Traditional Name: acetic acid [4-acetoxy-2-(azidomethyl)-5-(6-keto-3H-purin-9-yl)tetrahydrofuran-3-yl] ester Formula: C14H15N7O6 MolecularWeight: 377.3122

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(OC(C1OC(=O)C)N2C=NC3=C2NC=NC3=O)CN=[N+]=[N-]

Isomeric SMILES

CC(=O)OC1C(OC(C1OC(=O)C)N2C=NC3=C2NC=NC3=O)CN=[N+]=[N-]

InChI

InChI=1S/C14H15N7O6/c1-6(22)25-10-8(3-19-20-15)27-14(11(10)26-7(2)23)21-5-18-9-12(21)16-4-17-13(9)24/h4-5,8,10-11,14H,3H2,1-2H3,(H,16,17,24)