[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]-3-(2-methylpropanoyloxy)propyl] 2-methylpropanoate

Systemtic Name: [2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]-3-(2-methylpropanoyloxy)propyl] 2-methylpropanoate Openeye Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-(2-methylpropanoyloxy)propyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-(2-methyl-1-oxopropoxy)propyl] ester IUPAC Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-(2-methylpropanoyloxy)propyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]-3-isobutyryloxy-propyl] ester Formula: C17H25N5O6 MolecularWeight: 395.4103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OCC(COC(=O)C(C)C)OCN1C=NC2=C1NC(=NC2=O)N

Isomeric SMILES

CC(C)C(=O)OCC(COC(=O)C(C)C)OCN1C=NC2=C1NC(=NC2=O)N

InChI

InChI=1S/C17H25N5O6/c1-9(2)15(24)26-5-11(6-27-16(25)10(3)4)28-8-22-7-19-12-13(22)20-17(18)21-14(12)23/h7,9-11H,5-6,8H2,1-4H3,(H3,18,20,21,23)