disodium [hexyl(phosphonatomethyl)amino]methylphosphonic acid

Systemtic Name: disodium [hexyl(phosphonatomethyl)amino]methylphosphonic acid Openeye Name: disodium [hexyl(phosphonatomethyl)amino]methylphosphonic acid CAS Name: disodium [hexyl(phosphonatomethyl)amino]methylphosphonic acid IUPAC Name: disodium [hexyl(phosphonatomethyl)amino]methylphosphonic acid Traditional Name: disodium [hexyl(phosphonatomethyl)amino]methylphosphonic acid Formula: C8H19NNa2O6P2 MolecularWeight: 333.166622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H21NO6P2.2Na/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);;/q;2*+1/p-2