diazanium [phosphonatomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid

Systemtic Name: diazanium [phosphonatomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid Openeye Name: diammonium [phosphonatomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid CAS Name: diammonium [phosphonatomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid IUPAC Name: diazanium [phosphonatomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid Traditional Name: diammonium [phosphonatomethyl(3,5,5-trimethylhexyl)amino]methylphosphonic acid Formula: C11H33N3O6P2 MolecularWeight: 365.343742

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN(CP(=O)(O)O)CP(=O)([O-])[O-])CC(C)(C)C.[NH4+].[NH4+]

Isomeric SMILES

CC(CCN(CP(=O)(O)O)CP(=O)([O-])[O-])CC(C)(C)C.[NH4+].[NH4+]

InChI

InChI=1S/C11H27NO6P2.2H3N/c1-10(7-11(2,3)4)5-6-12(8-19(13,14)15)9-20(16,17)18;;/h10H,5-9H2,1-4H3,(H2,13,14,15)(H2,16,17,18);2*1H3