2-[1-(diethoxyphosphorylmethoxy)propoxy]-7H-purin-6-amine

Systemtic Name: 2-[1-(diethoxyphosphorylmethoxy)propoxy]-7H-purin-6-amine Openeye Name: 2-[1-(diethoxyphosphorylmethoxy)propoxy]-7H-purin-6-amine CAS Name: 2-[1-(diethoxyphosphorylmethoxy)propoxy]-7H-purin-6-amine IUPAC Name: 2-[1-(diethoxyphosphorylmethoxy)propoxy]-7H-purin-6-amine Traditional Name: [2-[1-(diethoxyphosphorylmethoxy)propoxy]-7H-purin-6-yl]amine Formula: C13H22N5O5P MolecularWeight: 359.318041

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Descriptors Computed from Structure

Canonical SMILES:

CCC(OCP(=O)(OCC)OCC)OC1=NC2=C(C(=N1)N)NC=N2

Isomeric SMILES

CCC(OCP(=O)(OCC)OCC)OC1=NC2=C(C(=N1)N)NC=N2

InChI

InChI=1S/C13H22N5O5P/c1-4-9(20-8-24(19,21-5-2)22-6-3)23-13-17-11(14)10-12(18-13)16-7-15-10/h7,9H,4-6,8H2,1-3H3,(H3,14,15,16,17,18)