[(2R,5R)-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methyl benzoate

Systemtic Name: [(2R,5R)-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methyl benzoate Openeye Name: [(2R,5R)-5-(6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [(2R,5R)-5-(6-oxo-3H-purin-9-yl)-2-oxolanyl]methyl ester IUPAC Name: [(2R,5R)-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2R,5R)-5-(6-keto-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl ester Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1COC(=O)C2=CC=CC=C2)N3C=NC4=C3NC=NC4=O

Isomeric SMILES

C1C[C@@H](O[C@H]1COC(=O)C2=CC=CC=C2)N3C=NC4=C3NC=NC4=O

InChI

InChI=1S/C17H16N4O4/c22-16-14-15(18-9-19-16)21(10-20-14)13-7-6-12(25-13)8-24-17(23)11-4-2-1-3-5-11/h1-5,9-10,12-13H,6-8H2,(H,18,19,22)/t12-,13-/m1/s1