1-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethoxymethylphosphonic acid

Systemtic Name: 1-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethoxymethylphosphonic acid Openeye Name: 1-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxymethylphosphonic acid CAS Name: 1-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxymethylphosphonic acid IUPAC Name: 1-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxymethylphosphonic acid Traditional Name: 1-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethoxymethylphosphonic acid Formula: C9H14N5O6P MolecularWeight: 319.211121

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Descriptors Computed from Structure

Canonical SMILES:

CC(OCN1C=NC2=C1NC(=NC2=O)N)OCP(=O)(O)O

Isomeric SMILES

CC(OCN1C=NC2=C1NC(=NC2=O)N)OCP(=O)(O)O

InChI

InChI=1S/C9H14N5O6P/c1-5(20-4-21(16,17)18)19-3-14-2-11-6-7(14)12-9(10)13-8(6)15/h2,5H,3-4H2,1H3,(H2,16,17,18)(H3,10,12,13,15)