ethyl 2-[2-(6-aminopurin-9-yl)oxyethoxymethyl-(2-ethoxy-2-oxidanylidene-ethoxy)phosphoryl]oxyethanoate

Systemtic Name: ethyl 2-[2-(6-aminopurin-9-yl)oxyethoxymethyl-(2-ethoxy-2-oxidanylidene-ethoxy)phosphoryl]oxyethanoate Openeye Name: ethyl 2-[2-(6-aminopurin-9-yl)oxyethoxymethyl-(2-ethoxy-2-oxo-ethoxy)phosphoryl]oxyacetate CAS Name: 2-[2-(6-aminopurin-9-yl)oxyethoxymethyl-(2-ethoxy-2-oxoethoxy)phosphoryl]oxyacetic acid ethyl ester IUPAC Name: ethyl 2-[2-(6-aminopurin-9-yl)oxyethoxymethyl-(2-ethoxy-2-oxoethoxy)phosphoryl]oxyacetate Traditional Name: 2-[2-adenin-9-yloxyethoxymethyl-(2-ethoxy-2-keto-ethoxy)phosphoryl]oxyacetic acid ethyl ester Formula: C16H24N5O9P MolecularWeight: 461.363621

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COP(=O)(COCCON1C=NC2=C1N=CN=C2N)OCC(=O)OCC

Isomeric SMILES

CCOC(=O)COP(=O)(COCCON1C=NC2=C1N=CN=C2N)OCC(=O)OCC

InChI

InChI=1S/C16H24N5O9P/c1-3-26-12(22)7-29-31(24,30-8-13(23)27-4-2)11-25-5-6-28-21-10-20-14-15(17)18-9-19-16(14)21/h9-10H,3-8,11H2,1-2H3,(H2,17,18,19)