6-chloranyl-2-[2-(diethoxyphosphorylmethoxy)propoxy]-3-phenylmethoxy-purine

Systemtic Name: 6-chloranyl-2-[2-(diethoxyphosphorylmethoxy)propoxy]-3-phenylmethoxy-purine Openeye Name: 3-benzyloxy-6-chloro-2-[2-(diethoxyphosphorylmethoxy)propoxy]purine CAS Name: 6-chloro-2-[2-(diethoxyphosphorylmethoxy)propoxy]-3-phenylmethoxypurine IUPAC Name: 6-chloro-2-[2-(diethoxyphosphorylmethoxy)propoxy]-3-phenylmethoxypurine Traditional Name: 3-benzoxy-6-chloro-2-[2-(diethoxyphosphorylmethoxy)propoxy]purine Formula: C20H26ClN4O6P MolecularWeight: 484.870401

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(COC(C)COC1=NC(=C2C(=NC=N2)N1OCC3=CC=CC=C3)Cl)OCC

Isomeric SMILES

CCOP(=O)(COC(C)COC1=NC(=C2C(=NC=N2)N1OCC3=CC=CC=C3)Cl)OCC

InChI

InChI=1S/C20H26ClN4O6P/c1-4-30-32(26,31-5-2)14-28-15(3)11-27-20-24-18(21)17-19(23-13-22-17)25(20)29-12-16-9-7-6-8-10-16/h6-10,13,15H,4-5,11-12,14H2,1-3H3