2-[2-azanyl-9-[2-[di(propan-2-yloxy)phosphorylmethoxy]propyl]purin-6-yl]guanidine

Systemtic Name: 2-[2-azanyl-9-[2-[di(propan-2-yloxy)phosphorylmethoxy]propyl]purin-6-yl]guanidine Openeye Name: 2-[2-amino-9-[2-(diisopropoxyphosphorylmethoxy)propyl]purin-6-yl]guanidine CAS Name: 2-[2-amino-9-[2-[di(propan-2-yloxy)phosphorylmethoxy]propyl]-6-purinyl]guanidine IUPAC Name: 2-[2-amino-9-[2-[di(propan-2-yloxy)phosphorylmethoxy]propyl]purin-6-yl]guanidine Traditional Name: 2-[2-amino-9-[2-(diisopropoxyphosphorylmethoxy)propyl]purin-6-yl]guanidine Formula: C16H29N8O4P MolecularWeight: 428.426421

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(COC(C)CN1C=NC2=C(N=C(N=C21)N)N=C(N)N)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(COC(C)CN1C=NC2=C(N=C(N=C21)N)N=C(N)N)OC(C)C

InChI

InChI=1S/C16H29N8O4P/c1-9(2)27-29(25,28-10(3)4)8-26-11(5)6-24-7-20-12-13(21-15(17)18)22-16(19)23-14(12)24/h7,9-11H,6,8H2,1-5H3,(H6,17,18,19,21,22,23)