[2-azanyl-3-oxidanyl-6-oxidanylidene-2-(propoxymethyl)-7,8-dihydro-1H-purin-9-yl] hexanoate

Systemtic Name: [2-azanyl-3-oxidanyl-6-oxidanylidene-2-(propoxymethyl)-7,8-dihydro-1H-purin-9-yl] hexanoate Openeye Name: [2-amino-3-hydroxy-6-oxo-2-(propoxymethyl)-7,8-dihydro-1H-purin-9-yl] hexanoate CAS Name: hexanoic acid [2-amino-3-hydroxy-6-oxo-2-(propoxymethyl)-7,8-dihydro-1H-purin-9-yl] ester IUPAC Name: [2-amino-3-hydroxy-6-oxo-2-(propoxymethyl)-7,8-dihydro-1H-purin-9-yl] hexanoate Traditional Name: hexanoic acid [2-amino-3-hydroxy-6-keto-2-(propoxymethyl)-7,8-dihydro-1H-purin-9-yl] ester Formula: C15H27N5O5 MolecularWeight: 357.40538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)ON1CNC2=C1N(C(NC2=O)(COCCC)N)O

Isomeric SMILES

CCCCCC(=O)ON1CNC2=C1N(C(NC2=O)(COCCC)N)O

InChI

InChI=1S/C15H27N5O5/c1-3-5-6-7-11(21)25-19-10-17-12-13(22)18-15(16,9-24-8-4-2)20(23)14(12)19/h17,23H,3-10,16H2,1-2H3,(H,18,22)