tetrasodium 4-azanyl-1,1-diphosphonato-butan-1-ol

Systemtic Name: tetrasodium 4-azanyl-1,1-diphosphonato-butan-1-ol Openeye Name: tetrasodium 4-amino-1,1-diphosphonato-butan-1-ol CAS Name: tetrasodium 4-amino-1,1-diphosphonato-1-butanol IUPAC Name: tetrasodium 4-amino-1,1-diphosphonatobutan-1-ol Traditional Name: tetrasodium 4-amino-1,1-diphosphonato-butan-1-ol Formula: C4H9NNa4O7P2 MolecularWeight: 337.023362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-])CN.[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

C(CC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-])CN.[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C4H13NO7P2.4Na/c5-3-1-2-4(6,13(7,8)9)14(10,11)12;;;;/h6H,1-3,5H2,(H2,7,8,9)(H2,10,11,12);;;;/q;4*+1/p-4