[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(2-propan-2-yloxyethanoyloxy)phosphoryl] 2-propan-2-yloxyethanoate

Systemtic Name: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(2-propan-2-yloxyethanoyloxy)phosphoryl] 2-propan-2-yloxyethanoate Openeye Name: [[(1R)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methyl-(2-isopropoxyacetyl)oxy-phosphoryl] 2-isopropoxyacetate CAS Name: 2-propan-2-yloxyacetic acid [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(1-oxo-2-propan-2-yloxyethoxy)phosphoryl] ester IUPAC Name: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(2-propan-2-yloxyacetyl)oxyphosphoryl] 2-propan-2-yloxyacetate Traditional Name: 2-isopropoxyacetic acid [[(1R)-2-adenin-9-yl-1-methyl-ethoxy]methyl-(2-isopropoxyacetyl)oxy-phosphoryl] ester Formula: C19H30N5O8P MolecularWeight: 487.443961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](CN1C=NC2=C1N=CN=C2N)OCP(=O)(OC(=O)COC(C)C)OC(=O)COC(C)C

InChI

InChI=1S/C19H30N5O8P/c1-12(2)28-7-15(25)31-33(27,32-16(26)8-29-13(3)4)11-30-14(5)6-24-10-23-17-18(20)21-9-22-19(17)24/h9-10,12-14H,6-8,11H2,1-5H3,(H2,20,21,22)/t14-/m1/s1