diazanium [hexyl(phosphonatomethyl)amino]methylphosphonic acid

Systemtic Name: diazanium [hexyl(phosphonatomethyl)amino]methylphosphonic acid Openeye Name: diammonium [hexyl(phosphonatomethyl)amino]methylphosphonic acid CAS Name: diammonium [hexyl(phosphonatomethyl)amino]methylphosphonic acid IUPAC Name: diazanium [hexyl(phosphonatomethyl)amino]methylphosphonic acid Traditional Name: diammonium [hexyl(phosphonatomethyl)amino]methylphosphonic acid Formula: C8H27N3O6P2 MolecularWeight: 323.264002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CP(=O)(O)O)CP(=O)([O-])[O-].[NH4+].[NH4+]

Isomeric SMILES

CCCCCCN(CP(=O)(O)O)CP(=O)([O-])[O-].[NH4+].[NH4+]

InChI

InChI=1S/C8H21NO6P2.2H3N/c1-2-3-4-5-6-9(7-16(10,11)12)8-17(13,14)15;;/h2-8H2,1H3,(H2,10,11,12)(H2,13,14,15);2*1H3