ethyl 3-[3,4-bis(oxidanyl)-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]propanoate

Systemtic Name: ethyl 3-[3,4-bis(oxidanyl)-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]propanoate Openeye Name: ethyl 3-[3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]propanoate CAS Name: 3-[3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)-2-oxolanyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]propanoate Traditional Name: 3-[3,4-dihydroxy-5-(6-keto-3H-purin-9-yl)tetrahydrofuran-2-yl]propionic acid ethyl ester Formula: C14H18N4O6 MolecularWeight: 338.31592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1C(C(C(O1)N2C=NC3=C2NC=NC3=O)O)O

Isomeric SMILES

CCOC(=O)CCC1C(C(C(O1)N2C=NC3=C2NC=NC3=O)O)O

InChI

InChI=1S/C14H18N4O6/c1-2-23-8(19)4-3-7-10(20)11(21)14(24-7)18-6-17-9-12(18)15-5-16-13(9)22/h5-7,10-11,14,20-21H,2-4H2,1H3,(H,15,16,22)