4-(methylamino)-1,1-diphosphonato-butan-1-ol

Systemtic Name: 4-(methylamino)-1,1-diphosphonato-butan-1-ol Openeye Name: 4-(methylamino)-1,1-diphosphonato-butan-1-ol CAS Name: 4-(methylamino)-1,1-diphosphonato-1-butanol IUPAC Name: 4-(methylamino)-1,1-diphosphonatobutan-1-ol Traditional Name: 4-(methylamino)-1,1-diphosphonato-butan-1-ol Formula: C5H11NO7P2-4 MolecularWeight: 259.090862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNCCCC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-]

Isomeric SMILES

CNCCCC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-]

InChI

InChI=1S/C5H15NO7P2/c1-6-4-2-3-5(7,14(8,9)10)15(11,12)13/h6-7H,2-4H2,1H3,(H2,8,9,10)(H2,11,12,13)/p-4