[3-[(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)methoxy]-2-oxidanyl-propyl] octanoate

Systemtic Name: [3-[(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)methoxy]-2-oxidanyl-propyl] octanoate Openeye Name: [3-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methoxy]-2-hydroxy-propyl] octanoate CAS Name: octanoic acid [3-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methoxy]-2-hydroxypropyl] ester IUPAC Name: [3-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)methoxy]-2-hydroxypropyl] octanoate Traditional Name: caprylic acid [3-[(2-amino-6-keto-7,8-dihydro-3H-purin-9-yl)methoxy]-2-hydroxy-propyl] ester Formula: C17H29N5O5 MolecularWeight: 383.44266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC(COCN1CNC2=C1NC(=NC2=O)N)O

Isomeric SMILES

CCCCCCCC(=O)OCC(COCN1CNC2=C1NC(=NC2=O)N)O

InChI

InChI=1S/C17H29N5O5/c1-2-3-4-5-6-7-13(24)27-9-12(23)8-26-11-22-10-19-14-15(22)20-17(18)21-16(14)25/h12,19,23H,2-11H2,1H3,(H3,18,20,21,25)