[3-[1-(6-chloranylpurin-9-yl)oxypropoxy]-3-diethoxyphosphoryl-propyl] ethanoate

Systemtic Name: [3-[1-(6-chloranylpurin-9-yl)oxypropoxy]-3-diethoxyphosphoryl-propyl] ethanoate Openeye Name: [3-[1-(6-chloropurin-9-yl)oxypropoxy]-3-diethoxyphosphoryl-propyl] acetate CAS Name: acetic acid [3-[1-[(6-chloro-9-purinyl)oxy]propoxy]-3-diethoxyphosphorylpropyl] ester IUPAC Name: [3-[1-(6-chloropurin-9-yl)oxypropoxy]-3-diethoxyphosphorylpropyl] acetate Traditional Name: acetic acid [3-[1-(6-chloropurin-9-yl)oxypropoxy]-3-diethoxyphosphoryl-propyl] ester Formula: C17H26ClN4O7P MolecularWeight: 464.837701

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Descriptors Computed from Structure

Canonical SMILES:

CCC(OC(CCOC(=O)C)P(=O)(OCC)OCC)ON1C=NC2=C1N=CN=C2Cl

Isomeric SMILES

CCC(OC(CCOC(=O)C)P(=O)(OCC)OCC)ON1C=NC2=C1N=CN=C2Cl

InChI

InChI=1S/C17H26ClN4O7P/c1-5-13(29-22-11-21-15-16(18)19-10-20-17(15)22)28-14(8-9-25-12(4)23)30(24,26-6-2)27-7-3/h10-11,13-14H,5-9H2,1-4H3