trisodium [2-ethylhexyl(phosphonatomethyl)amino]methyl-oxidanyl-phosphinate

Systemtic Name: trisodium [2-ethylhexyl(phosphonatomethyl)amino]methyl-oxidanyl-phosphinate Openeye Name: trisodium [2-ethylhexyl(phosphonatomethyl)amino]methyl-hydroxy-phosphinate CAS Name: trisodium [2-ethylhexyl(phosphonatomethyl)amino]methyl-hydroxyphosphinate IUPAC Name: trisodium [2-ethylhexyl(phosphonatomethyl)amino]methyl-hydroxyphosphinate Traditional Name: trisodium [2-ethylhexyl(phosphonatomethyl)amino]methyl-hydroxy-phosphinate Formula: C10H22NNa3O6P2 MolecularWeight: 383.201612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN(CP(=O)(O)[O-])CP(=O)([O-])[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

CCCCC(CC)CN(CP(=O)(O)[O-])CP(=O)([O-])[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C10H25NO6P2.3Na/c1-3-5-6-10(4-2)7-11(8-18(12,13)14)9-19(15,16)17;;;/h10H,3-9H2,1-2H3,(H2,12,13,14)(H2,15,16,17);;;/q;3*+1/p-3