[3-(6-aminopurin-9-yl)-2-oxidanyl-propyl] 2,2-dimethylpropanoate

Systemtic Name: [3-(6-aminopurin-9-yl)-2-oxidanyl-propyl] 2,2-dimethylpropanoate Openeye Name: [3-(6-aminopurin-9-yl)-2-hydroxy-propyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [3-(6-aminopurin-9-yl)-2-hydroxypropyl] ester IUPAC Name: [3-(6-aminopurin-9-yl)-2-hydroxypropyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid (3-adenin-9-yl-2-hydroxy-propyl) ester Formula: C13H19N5O3 MolecularWeight: 293.32166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCC(CN1C=NC2=C1N=CN=C2N)O

Isomeric SMILES

CC(C)(C)C(=O)OCC(CN1C=NC2=C1N=CN=C2N)O

InChI

InChI=1S/C13H19N5O3/c1-13(2,3)12(20)21-5-8(19)4-18-7-17-9-10(14)15-6-16-11(9)18/h6-8,19H,4-5H2,1-3H3,(H2,14,15,16)