trisodium (1S,2S)-1,2-bis(oxidanyl)propane-1,2,3-tricarboxylate

Systemtic Name: trisodium (1S,2S)-1,2-bis(oxidanyl)propane-1,2,3-tricarboxylate Openeye Name: trisodium (1S,2S)-1,2-dihydroxypropane-1,2,3-tricarboxylate CAS Name: trisodium (1S,2S)-1,2-dihydroxypropane-1,2,3-tricarboxylate IUPAC Name: trisodium (1S,2S)-1,2-dihydroxypropane-1,2,3-tricarboxylate Traditional Name: trisodium (1S,2S)-1,2-dihydroxypropane-1,2,3-tricarboxylate Formula: C6H5Na3O8 MolecularWeight: 274.06841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)[O-])C(C(C(=O)[O-])O)(C(=O)[O-])O.[Na+].[Na+].[Na+]

Isomeric SMILES

C(C(=O)[O-])[C@]([C@@H](C(=O)[O-])O)(C(=O)[O-])O.[Na+].[Na+].[Na+]

InChI

InChI=1S/C6H8O8.3Na/c7-2(8)1-6(14,5(12)13)3(9)4(10)11;;;/h3,9,14H,1H2,(H,7,8)(H,10,11)(H,12,13);;;/q;3*+1/p-3/t3-,6+;;;/m1.../s1