[(2S)-1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-phosphonooxy-propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [(2S)-1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-phosphonooxy-propan-2-yl]oxymethylphosphonic acid Openeye Name: [(1S)-1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-2-phosphonooxy-ethoxy]methylphosphonic acid CAS Name: [(2S)-1-(4-amino-2-oxo-1-pyrimidinyl)-3-phosphonooxypropan-2-yl]oxymethylphosphonic acid IUPAC Name: [(2S)-1-(4-amino-2-oxopyrimidin-1-yl)-3-phosphonooxypropan-2-yl]oxymethylphosphonic acid Traditional Name: [(1S)-1-[(4-amino-2-keto-pyrimidin-1-yl)methyl]-2-phosphonooxy-ethoxy]methylphosphonic acid Formula: C8H15N3O9P2 MolecularWeight: 359.166922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1N)CC(COP(=O)(O)O)OCP(=O)(O)O

Isomeric SMILES

C1=CN(C(=O)N=C1N)C[C@@H](COP(=O)(O)O)OCP(=O)(O)O

InChI

InChI=1S/C8H15N3O9P2/c9-7-1-2-11(8(12)10-7)3-6(4-20-22(16,17)18)19-5-21(13,14)15/h1-2,6H,3-5H2,(H2,9,10,12)(H2,13,14,15)(H2,16,17,18)/t6-/m0/s1