1-oxidanylpropane-1,1,3-tricarboxylic acid; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 1-oxidanylpropane-1,1,3-tricarboxylic acid; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; 1-hydroxypropane-1,1,3-tricarboxylic acid CAS Name: 1-hydroxypropane-1,1,3-tricarboxylic acid; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: 1-hydroxypropane-1,1,3-tricarboxylic acid; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: citric acid; 1-hydroxypropane-1,1,3-tricarboxylic acid Formula: C12H16O14 MolecularWeight: 384.24704

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(C(=O)O)(C(=O)O)O)C(=O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

C(CC(C(=O)O)(C(=O)O)O)C(=O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/2C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10;7-3(8)1-2-6(13,4(9)10)5(11)12/h2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)