3-(2-azanyl-4-oxidanylidene-1H-pyrimidin-6-yl)propoxymethylphosphonic acid

Systemtic Name: 3-(2-azanyl-4-oxidanylidene-1H-pyrimidin-6-yl)propoxymethylphosphonic acid Openeye Name: 3-(2-amino-4-oxo-1H-pyrimidin-6-yl)propoxymethylphosphonic acid CAS Name: 3-(2-amino-4-oxo-1H-pyrimidin-6-yl)propoxymethylphosphonic acid IUPAC Name: 3-(2-amino-4-oxo-1H-pyrimidin-6-yl)propoxymethylphosphonic acid Traditional Name: 3-(2-amino-4-keto-1H-pyrimidin-6-yl)propoxymethylphosphonic acid Formula: C8H14N3O5P MolecularWeight: 263.187621

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=NC1=O)N)CCCOCP(=O)(O)O

Isomeric SMILES

C1=C(NC(=NC1=O)N)CCCOCP(=O)(O)O

InChI

InChI=1S/C8H14N3O5P/c9-8-10-6(4-7(12)11-8)2-1-3-16-5-17(13,14)15/h4H,1-3,5H2,(H2,13,14,15)(H3,9,10,11,12)