(4-oxidanyl-4,4-diphosphono-butyl)azanium

Systemtic Name: (4-oxidanyl-4,4-diphosphono-butyl)azanium Openeye Name: (4-hydroxy-4,4-diphosphono-butyl)ammonium CAS Name: (4-hydroxy-4,4-diphosphonobutyl)ammonium IUPAC Name: (4-hydroxy-4,4-diphosphonobutyl)azanium Traditional Name: (4-hydroxy-4,4-diphosphono-butyl)ammonium Formula: C4H14NO7P2+ MolecularWeight: 250.103982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CC(O)(P(=O)(O)O)P(=O)(O)O)C[NH3+]

Isomeric SMILES

C(CC(O)(P(=O)(O)O)P(=O)(O)O)C[NH3+]

InChI

InChI=1S/C4H13NO7P2/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)/p+1