[(E)-3-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)oxy-4-oxidanyl-but-1-enyl]phosphonic acid

Systemtic Name: [(E)-3-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)oxy-4-oxidanyl-but-1-enyl]phosphonic acid Openeye Name: [(E)-3-(4-amino-2-oxo-pyrimidin-1-yl)oxy-4-hydroxy-but-1-enyl]phosphonic acid CAS Name: [(E)-3-[(4-amino-2-oxo-1-pyrimidinyl)oxy]-4-hydroxybut-1-enyl]phosphonic acid IUPAC Name: [(E)-3-(4-amino-2-oxopyrimidin-1-yl)oxy-4-hydroxybut-1-enyl]phosphonic acid Traditional Name: [(E)-3-(4-amino-2-keto-pyrimidin-1-yl)oxy-4-hydroxy-but-1-enyl]phosphonic acid Formula: C8H12N3O6P MolecularWeight: 277.171141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1N)OC(CO)C=CP(=O)(O)O

Isomeric SMILES

C1=CN(C(=O)N=C1N)OC(CO)/C=C/P(=O)(O)O

InChI

InChI=1S/C8H12N3O6P/c9-7-1-3-11(8(13)10-7)17-6(5-12)2-4-18(14,15)16/h1-4,6,12H,5H2,(H2,9,10,13)(H2,14,15,16)/b4-2+