tetraazanium [bis(phosphonatomethyl)amino]methylphosphonic acid

Systemtic Name: tetraazanium [bis(phosphonatomethyl)amino]methylphosphonic acid Openeye Name: tetraammonium [bis(phosphonatomethyl)amino]methylphosphonic acid CAS Name: tetraammonium [bis(phosphonatomethyl)amino]methylphosphonic acid IUPAC Name: tetraazanium [bis(phosphonatomethyl)amino]methylphosphonic acid Traditional Name: tetraammonium [bis(phosphonatomethyl)amino]methylphosphonic acid Formula: C3H24N5O9P3 MolecularWeight: 367.172043

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Descriptors Computed from Structure

Canonical SMILES:

C(N(CP(=O)([O-])[O-])CP(=O)([O-])[O-])P(=O)(O)O.[NH4+].[NH4+].[NH4+].[NH4+]

Isomeric SMILES

C(N(CP(=O)([O-])[O-])CP(=O)([O-])[O-])P(=O)(O)O.[NH4+].[NH4+].[NH4+].[NH4+]

InChI

InChI=1S/C3H12NO9P3.4H3N/c5-14(6,7)1-4(2-15(8,9)10)3-16(11,12)13;;;;/h1-3H2,(H2,5,6,7)(H2,8,9,10)(H2,11,12,13);4*1H3