9-[2-[di(propan-2-yloxy)phosphorylmethoxy]-3-phenylmethoxy-propyl]-6-phenylmethoxy-purin-2-amine

Systemtic Name: 9-[2-[di(propan-2-yloxy)phosphorylmethoxy]-3-phenylmethoxy-propyl]-6-phenylmethoxy-purin-2-amine Openeye Name: 6-benzyloxy-9-[3-benzyloxy-2-(diisopropoxyphosphorylmethoxy)propyl]purin-2-amine CAS Name: 9-[2-[di(propan-2-yloxy)phosphorylmethoxy]-3-phenylmethoxypropyl]-6-phenylmethoxy-2-purinamine IUPAC Name: 9-[2-[di(propan-2-yloxy)phosphorylmethoxy]-3-phenylmethoxypropyl]-6-phenylmethoxypurin-2-amine Traditional Name: [6-benzoxy-9-[3-benzoxy-2-(diisopropoxyphosphorylmethoxy)propyl]purin-2-yl]amine Formula: C29H38N5O6P MolecularWeight: 583.615681

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(COC(CN1C=NC2=C1N=C(N=C2OCC3=CC=CC=C3)N)COCC4=CC=CC=C4)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(COC(CN1C=NC2=C1N=C(N=C2OCC3=CC=CC=C3)N)COCC4=CC=CC=C4)OC(C)C

InChI

InChI=1S/C29H38N5O6P/c1-21(2)39-41(35,40-22(3)4)20-38-25(18-36-16-23-11-7-5-8-12-23)15-34-19-31-26-27(34)32-29(30)33-28(26)37-17-24-13-9-6-10-14-24/h5-14,19,21-22,25H,15-18,20H2,1-4H3,(H2,30,32,33)