1-oxidanyl-4-oxidanylidene-pentan-2-olate; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 1-oxidanyl-4-oxidanylidene-pentan-2-olate; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; 1-hydroxy-4-oxo-pentan-2-olate CAS Name: 1-hydroxy-4-oxo-2-pentanolate; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: 1-hydroxy-4-oxopentan-2-olate; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: citric acid; 1-hydroxy-4-keto-pentan-2-olate Formula: C11H17O10- MolecularWeight: 309.24668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(CO)[O-].C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CC(=O)CC(CO)[O-].C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C6H8O7.C5H9O3/c7-3(8)1-6(13,5(11)12)2-4(9)10;1-4(7)2-5(8)3-6/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);5-6H,2-3H2,1H3/q;-1