2,2-diphosphonatoethyl-[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]azanium

Systemtic Name: 2,2-diphosphonatoethyl-[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]azanium Openeye Name: 2,2-diphosphonatoethyl-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]ammonium CAS Name: [1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-(2,2-diphosphonatoethyl)ammonium IUPAC Name: [1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-(2,2-diphosphonatoethyl)azanium Traditional Name: 2,2-diphosphonatoethyl-(2-hydroxy-1,1-dimethylol-ethyl)ammonium Formula: C6H14NO9P2-3 MolecularWeight: 306.124182

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Descriptors Computed from Structure

Canonical SMILES:

C(C(P(=O)([O-])[O-])P(=O)([O-])[O-])[NH2+]C(CO)(CO)CO

Isomeric SMILES

C(C(P(=O)([O-])[O-])P(=O)([O-])[O-])[NH2+]C(CO)(CO)CO

InChI

InChI=1S/C6H17NO9P2/c8-2-6(3-9,4-10)7-1-5(17(11,12)13)18(14,15)16/h5,7-10H,1-4H2,(H2,11,12,13)(H2,14,15,16)/p-3