6-azanyl-5-iodanyl-1H-pyrimidin-2-one; phosphono dihydrogen phosphate

Systemtic Name: 6-azanyl-5-iodanyl-1H-pyrimidin-2-one; phosphono dihydrogen phosphate Openeye Name: 6-amino-5-iodo-1H-pyrimidin-2-one; phosphono dihydrogen phosphate CAS Name: 6-amino-5-iodo-1H-pyrimidin-2-one; phosphono dihydrogen phosphate IUPAC Name: 6-amino-5-iodo-1H-pyrimidin-2-one; phosphono dihydrogen phosphate Traditional Name: 6-amino-5-iodo-1H-pyrimidin-2-one; phosphono dihydrogen phosphate Formula: C4H8IN3O8P2 MolecularWeight: 414.973612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=O)NC(=C1I)N.OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

C1=NC(=O)NC(=C1I)N.OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C4H4IN3O.H4O7P2/c5-2-1-7-4(9)8-3(2)6;1-8(2,3)7-9(4,5)6/h1H,(H3,6,7,8,9);(H2,1,2,3)(H2,4,5,6)