sodium; dihydrogen phosphate; 2-oxidanylpropane-1,2,3-tricarboxylic acid; dihydrate

Systemtic Name: sodium; dihydrogen phosphate; 2-oxidanylpropane-1,2,3-tricarboxylic acid; dihydrate Openeye Name: sodium; citric acid; dihydrogen phosphate; dihydrate CAS Name: sodium; dihydrogen phosphate; 2-hydroxypropane-1,2,3-tricarboxylic acid; dihydrate IUPAC Name: sodium; dihydrogen phosphate; 2-hydroxypropane-1,2,3-tricarboxylic acid; dihydrate Traditional Name: sodium; citric acid; dihydrogen phosphate; dihydrate Formula: C6H14NaO13P MolecularWeight: 348.131091

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H8O7.Na.H3O4P.2H2O/c7-3(8)1-6(13,5(11)12)2-4(9)10;;1-5(2,3)4;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;(H3,1,2,3,4);2*1H2/q;+1;;;/p-1