9-[2-[di(propan-2-yloxy)phosphorylmethoxy]ethyl]-N6-prop-2-enyl-purine-2,6-diamine

Systemtic Name: 9-[2-[di(propan-2-yloxy)phosphorylmethoxy]ethyl]-N6-prop-2-enyl-purine-2,6-diamine Openeye Name: N6-allyl-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purine-2,6-diamine CAS Name: 9-[2-[di(propan-2-yloxy)phosphorylmethoxy]ethyl]-N6-prop-2-enylpurine-2,6-diamine IUPAC Name: 9-[2-[di(propan-2-yloxy)phosphorylmethoxy]ethyl]-6-N-prop-2-enylpurine-2,6-diamine Traditional Name: allyl-[2-amino-9-[2-(diisopropoxyphosphorylmethoxy)ethyl]purin-6-yl]amine Formula: C17H29N6O4P MolecularWeight: 412.423721

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(COCCN1C=NC2=C1N=C(N=C2NCC=C)N)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(COCCN1C=NC2=C1N=C(N=C2NCC=C)N)OC(C)C

InChI

InChI=1S/C17H29N6O4P/c1-6-7-19-15-14-16(22-17(18)21-15)23(10-20-14)8-9-25-11-28(24,26-12(2)3)27-13(4)5/h6,10,12-13H,1,7-9,11H2,2-5H3,(H3,18,19,21,22)