trisodium 2-[1-hydroxyethyl(phosphonomethyl)amino]ethanoate

Systemtic Name: trisodium 2-[1-hydroxyethyl(phosphonomethyl)amino]ethanoate Openeye Name: trisodium 2-[1-hydroxyethyl(phosphonomethyl)amino]acetate CAS Name: trisodium 2-[1-hydroxyethyl(phosphonomethyl)amino]acetate IUPAC Name: trisodium 2-[1-hydroxyethyl(phosphonomethyl)amino]acetate Traditional Name: trisodium 2-[1-hydroxyethyl(phosphonomethyl)amino]acetate Formula: C15H33N3Na3O18P3 MolecularWeight: 705.322413

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C5H12NO6P.3Na/c3*1-4(7)6(2-5(8)9)3-13(10,11)12;;;/h3*4,7H,2-3H2,1H3,(H,8,9)(H2,10,11,12);;;/q;;;3*+1/p-3