[1-(6-aminopurin-9-yl)-3-methoxy-propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [1-(6-aminopurin-9-yl)-3-methoxy-propan-2-yl]oxymethylphosphonic acid Openeye Name: [1-[(6-aminopurin-9-yl)methyl]-2-methoxy-ethoxy]methylphosphonic acid CAS Name: [1-(6-aminopurin-9-yl)-3-methoxypropan-2-yl]oxymethylphosphonic acid IUPAC Name: [1-(6-aminopurin-9-yl)-3-methoxypropan-2-yl]oxymethylphosphonic acid Traditional Name: [1-(adenin-9-ylmethyl)-2-methoxy-ethoxy]methylphosphonic acid Formula: C10H16N5O5P MolecularWeight: 317.238301

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Descriptors Computed from Structure

Canonical SMILES:

COCC(CN1C=NC2=C1N=CN=C2N)OCP(=O)(O)O

Isomeric SMILES

COCC(CN1C=NC2=C1N=CN=C2N)OCP(=O)(O)O

InChI

InChI=1S/C10H16N5O5P/c1-19-3-7(20-6-21(16,17)18)2-15-5-14-8-9(11)12-4-13-10(8)15/h4-5,7H,2-3,6H2,1H3,(H2,11,12,13)(H2,16,17,18)