9-[(2R,5S)-5-(1-oxidanyl-2-oxidanylidene-propyl)oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 9-[(2R,5S)-5-(1-oxidanyl-2-oxidanylidene-propyl)oxolan-2-yl]-3H-purin-6-one Openeye Name: 9-[(2R,5S)-5-(1-hydroxy-2-oxo-propyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 9-[(2R,5S)-5-(1-hydroxy-2-oxopropyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 9-[(2R,5S)-5-(1-hydroxy-2-oxopropyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 9-[(2R,5S)-5-(1-hydroxy-2-keto-propyl)tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C12H14N4O4 MolecularWeight: 278.26396

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1CCC(O1)N2C=NC3=C2NC=NC3=O)O

Isomeric SMILES

CC(=O)C([C@@H]1CC[C@@H](O1)N2C=NC3=C2NC=NC3=O)O

InChI

InChI=1S/C12H14N4O4/c1-6(17)10(18)7-2-3-8(20-7)16-5-15-9-11(16)13-4-14-12(9)19/h4-5,7-8,10,18H,2-3H2,1H3,(H,13,14,19)/t7-,8+,10?/m0/s1