tetrasodium; dihydrogen phosphate; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: tetrasodium; dihydrogen phosphate; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: tetrasodium dihydrogen phosphate citrate CAS Name: tetrasodium; dihydrogen phosphate; 2-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: tetrasodium; dihydrogen phosphate; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: tetrasodium dihydrogen phosphate citrate Formula: C6H7Na4O11P MolecularWeight: 378.046021

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H8O7.4Na.H3O4P/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)/q;4*+1;/p-4