tetraazanium N,N-bis(phosphonatomethyl)hexan-1-amine

Systemtic Name: tetraazanium N,N-bis(phosphonatomethyl)hexan-1-amine Openeye Name: tetraammonium N,N-bis(phosphonatomethyl)hexan-1-amine CAS Name: tetraammonium N,N-bis(phosphonatomethyl)-1-hexanamine IUPAC Name: tetraazanium N,N-bis(phosphonatomethyl)hexan-1-amine Traditional Name: tetraammonium hexyl-bis(phosphonatomethyl)amine Formula: C8H33N5O6P2 MolecularWeight: 357.325042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H21NO6P2.4H3N/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);4*1H3