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

Systemtic Name: 9-[(2R,5S)-5-(1-oxidanyl-2-oxidanylidene-pentyl)oxolan-2-yl]-3H-purin-6-one Openeye Name: 9-[(2R,5S)-5-(1-hydroxy-2-oxo-pentyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 9-[(2R,5S)-5-(1-hydroxy-2-oxopentyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 9-[(2R,5S)-5-(1-hydroxy-2-oxopentyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 9-[(2R,5S)-5-(1-hydroxy-2-keto-pentyl)tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C14H18N4O4 MolecularWeight: 306.31712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N4O4/c1-2-3-8(19)12(20)9-4-5-10(22-9)18-7-17-11-13(18)15-6-16-14(11)21/h6-7,9-10,12,20H,2-5H2,1H3,(H,15,16,21)/t9-,10+,12?/m0/s1