1-[2-azanyl-6-(cyclopentylamino)purin-9-yl]propan-2-yloxymethylphosphonic acid

Systemtic Name: 1-[2-azanyl-6-(cyclopentylamino)purin-9-yl]propan-2-yloxymethylphosphonic acid Openeye Name: [2-[2-amino-6-(cyclopentylamino)purin-9-yl]-1-methyl-ethoxy]methylphosphonic acid CAS Name: 1-[2-amino-6-(cyclopentylamino)-9-purinyl]propan-2-yloxymethylphosphonic acid IUPAC Name: 1-[2-amino-6-(cyclopentylamino)purin-9-yl]propan-2-yloxymethylphosphonic acid Traditional Name: [2-[2-amino-6-(cyclopentylamino)purin-9-yl]-1-methyl-ethoxy]methylphosphonic acid Formula: C14H23N6O4P MolecularWeight: 370.343981

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=NC2=C1N=C(N=C2NC3CCCC3)N)OCP(=O)(O)O

Isomeric SMILES

CC(CN1C=NC2=C1N=C(N=C2NC3CCCC3)N)OCP(=O)(O)O

InChI

InChI=1S/C14H23N6O4P/c1-9(24-8-25(21,22)23)6-20-7-16-11-12(17-10-4-2-3-5-10)18-14(15)19-13(11)20/h7,9-10H,2-6,8H2,1H3,(H2,21,22,23)(H3,15,17,18,19)