2-oxidanylpropane-1,2,3-tricarboxylate chloride sulfate

Systemtic Name: 2-oxidanylpropane-1,2,3-tricarboxylate chloride sulfate Openeye Name: chloride citrate sulfate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate chloride sulfate IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate chloride sulfate Traditional Name: chloride citrate sulfate Formula: C6H5ClO11S-6 MolecularWeight: 320.6153

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[O-]S(=O)(=O)[O-].[Cl-]

Isomeric SMILES

C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[O-]S(=O)(=O)[O-].[Cl-]

InChI

InChI=1S/C6H8O7.ClH.H2O4S/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);1H;(H2,1,2,3,4)/p-6