diazanium [phosphonatomethyl(phosphonomethyl)amino]methylphosphonic acid

Systemtic Name: diazanium [phosphonatomethyl(phosphonomethyl)amino]methylphosphonic acid Openeye Name: diammonium [phosphonatomethyl(phosphonomethyl)amino]methylphosphonic acid CAS Name: diammonium [phosphonatomethyl(phosphonomethyl)amino]methylphosphonic acid IUPAC Name: diazanium [phosphonatomethyl(phosphonomethyl)amino]methylphosphonic acid Traditional Name: diammonium [phosphonatomethyl(phosphonomethyl)amino]methylphosphonic acid Formula: C3H18N3O9P3 MolecularWeight: 333.111003

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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+]

Isomeric SMILES

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

InChI

InChI=1S/C3H12NO9P3.2H3N/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);2*1H3