(6-azanyl-8-ethyl-7H-purin-2-yl)oxymethylphosphonic acid

Systemtic Name: (6-azanyl-8-ethyl-7H-purin-2-yl)oxymethylphosphonic acid Openeye Name: (6-amino-8-ethyl-7H-purin-2-yl)oxymethylphosphonic acid CAS Name: (6-amino-8-ethyl-7H-purin-2-yl)oxymethylphosphonic acid IUPAC Name: (6-amino-8-ethyl-7H-purin-2-yl)oxymethylphosphonic acid Traditional Name: (6-amino-8-ethyl-7H-purin-2-yl)oxymethylphosphonic acid Formula: C8H12N5O4P MolecularWeight: 273.185741

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1)C(=NC(=N2)OCP(=O)(O)O)N

Isomeric SMILES

CCC1=NC2=C(N1)C(=NC(=N2)OCP(=O)(O)O)N

InChI

InChI=1S/C8H12N5O4P/c1-2-4-10-5-6(9)12-8(13-7(5)11-4)17-3-18(14,15)16/h2-3H2,1H3,(H2,14,15,16)(H3,9,10,11,12,13)