potassium [6-[bis(phosphonomethyl)amino]hexyl-(phosphonomethyl)amino]methyl-oxidanyl-phosphinate

Systemtic Name: potassium [6-[bis(phosphonomethyl)amino]hexyl-(phosphonomethyl)amino]methyl-oxidanyl-phosphinate Openeye Name: potassium [6-[bis(phosphonomethyl)amino]hexyl-(phosphonomethyl)amino]methyl-hydroxy-phosphinate CAS Name: potassium [6-[bis(phosphonomethyl)amino]hexyl-(phosphonomethyl)amino]methyl-hydroxyphosphinate IUPAC Name: potassium [6-[bis(phosphonomethyl)amino]hexyl-(phosphonomethyl)amino]methyl-hydroxyphosphinate Traditional Name: potassium [6-[bis(phosphonomethyl)amino]hexyl-(phosphonomethyl)amino]methyl-hydroxy-phosphinate Formula: C10H27KN2O12P4 MolecularWeight: 530.320924

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCN(CP(=O)(O)O)CP(=O)(O)[O-])CCN(CP(=O)(O)O)CP(=O)(O)O.[K+]

Isomeric SMILES

C(CCCN(CP(=O)(O)O)CP(=O)(O)[O-])CCN(CP(=O)(O)O)CP(=O)(O)O.[K+]

InChI

InChI=1S/C10H28N2O12P4.K/c13-25(14,15)7-11(8-26(16,17)18)5-3-1-2-4-6-12(9-27(19,20)21)10-28(22,23)24;/h1-10H2,(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24);/q;+1/p-1