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

Systemtic Name: 1-[2-azanyl-6-(cyclohexylamino)purin-9-yl]propan-2-yloxymethylphosphonic acid Openeye Name: [2-[2-amino-6-(cyclohexylamino)purin-9-yl]-1-methyl-ethoxy]methylphosphonic acid CAS Name: 1-[2-amino-6-(cyclohexylamino)-9-purinyl]propan-2-yloxymethylphosphonic acid IUPAC Name: 1-[2-amino-6-(cyclohexylamino)purin-9-yl]propan-2-yloxymethylphosphonic acid Traditional Name: [2-[2-amino-6-(cyclohexylamino)purin-9-yl]-1-methyl-ethoxy]methylphosphonic acid Formula: C15H25N6O4P MolecularWeight: 384.370561

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=NC2=C1N=C(N=C2NC3CCCCC3)N)OCP(=O)(O)O

Isomeric SMILES

CC(CN1C=NC2=C1N=C(N=C2NC3CCCCC3)N)OCP(=O)(O)O

InChI

InChI=1S/C15H25N6O4P/c1-10(25-9-26(22,23)24)7-21-8-17-12-13(19-15(16)20-14(12)21)18-11-5-3-2-4-6-11/h8,10-11H,2-7,9H2,1H3,(H2,22,23,24)(H3,16,18,19,20)