trisodium 2-(carboxymethyloxy)butanedioate pentahydrate

Systemtic Name: trisodium 2-(carboxymethyloxy)butanedioate pentahydrate Openeye Name: trisodium 2-(carboxymethyloxy)butanedioate pentahydrate CAS Name: trisodium 2-(carboxymethyloxy)butanedioate pentahydrate IUPAC Name: trisodium 2-(carboxymethyloxy)butanedioate pentahydrate Traditional Name: trisodium 2-(carboxymethyloxy)succinate pentahydrate Formula: C6H16Na3O12+ MolecularWeight: 349.15335

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H8O7.3Na.5H2O/c7-4(8)1-3(6(11)12)13-2-5(9)10;;;;;;;;/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;;5*1H2/q;3*+1;;;;;/p-2