[3-oxidanyl-2-[[6-oxidanylidene-2-(propanoylamino)-3H-purin-9-yl]methoxy]propyl] propanoate

Systemtic Name: [3-oxidanyl-2-[[6-oxidanylidene-2-(propanoylamino)-3H-purin-9-yl]methoxy]propyl] propanoate Openeye Name: [3-hydroxy-2-[[6-oxo-2-(propanoylamino)-3H-purin-9-yl]methoxy]propyl] propanoate CAS Name: propanoic acid [3-hydroxy-2-[[6-oxo-2-(1-oxopropylamino)-3H-purin-9-yl]methoxy]propyl] ester IUPAC Name: [3-hydroxy-2-[[6-oxo-2-(propanoylamino)-3H-purin-9-yl]methoxy]propyl] propanoate Traditional Name: propionic acid [3-hydroxy-2-[(6-keto-2-propionamido-3H-purin-9-yl)methoxy]propyl] ester Formula: C15H21N5O6 MolecularWeight: 367.35714

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC(=O)C2=C(N1)N(C=N2)COC(CO)COC(=O)CC

Isomeric SMILES

CCC(=O)NC1=NC(=O)C2=C(N1)N(C=N2)COC(CO)COC(=O)CC

InChI

InChI=1S/C15H21N5O6/c1-3-10(22)17-15-18-13-12(14(24)19-15)16-7-20(13)8-26-9(5-21)6-25-11(23)4-2/h7,9,21H,3-6,8H2,1-2H3,(H2,17,18,19,22,24)