(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxymethoxymethylphosphonic acid

Systemtic Name: (2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxymethoxymethylphosphonic acid Openeye Name: (2-amino-6-oxo-3H-purin-9-yl)methoxymethoxymethylphosphonic acid CAS Name: (2-amino-6-oxo-3H-purin-9-yl)methoxymethoxymethylphosphonic acid IUPAC Name: (2-amino-6-oxo-3H-purin-9-yl)methoxymethoxymethylphosphonic acid Traditional Name: (2-amino-6-keto-3H-purin-9-yl)methoxymethoxymethylphosphonic acid Formula: C8H12N5O6P MolecularWeight: 305.184541

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1COCOCP(=O)(O)O)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1COCOCP(=O)(O)O)NC(=NC2=O)N

InChI

InChI=1S/C8H12N5O6P/c9-8-11-6-5(7(14)12-8)10-1-13(6)2-18-3-19-4-20(15,16)17/h1H,2-4H2,(H2,15,16,17)(H3,9,11,12,14)