9-[4-bromanyl-3-ethanoyl-3-oxidanyl-5-(1-oxidanyl-2-oxidanylidene-propyl)oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 9-[4-bromanyl-3-ethanoyl-3-oxidanyl-5-(1-oxidanyl-2-oxidanylidene-propyl)oxolan-2-yl]-3H-purin-6-one Openeye Name: 9-[3-acetyl-4-bromo-3-hydroxy-5-(1-hydroxy-2-oxo-propyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 9-[3-acetyl-4-bromo-3-hydroxy-5-(1-hydroxy-2-oxopropyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 9-[3-acetyl-4-bromo-3-hydroxy-5-(1-hydroxy-2-oxopropyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 9-[3-acetyl-4-bromo-3-hydroxy-5-(1-hydroxy-2-keto-propyl)tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C14H15BrN4O6 MolecularWeight: 415.1961

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1C(C(C(O1)N2C=NC3=C2NC=NC3=O)(C(=O)C)O)Br)O

Isomeric SMILES

CC(=O)C(C1C(C(C(O1)N2C=NC3=C2NC=NC3=O)(C(=O)C)O)Br)O

InChI

InChI=1S/C14H15BrN4O6/c1-5(20)8(22)9-10(15)14(24,6(2)21)13(25-9)19-4-18-7-11(19)16-3-17-12(7)23/h3-4,8-10,13,22,24H,1-2H3,(H,16,17,23)