2-oxidanyl-3-propyl-hexane-1,2,3-tricarboxylic acid

Systemtic Name: 2-oxidanyl-3-propyl-hexane-1,2,3-tricarboxylic acid Openeye Name: 2-hydroxy-3-propyl-hexane-1,2,3-tricarboxylic acid CAS Name: 2-hydroxy-3-propylhexane-1,2,3-tricarboxylic acid IUPAC Name: 2-hydroxy-3-propylhexane-1,2,3-tricarboxylic acid Traditional Name: 2-hydroxy-3-propyl-hexane-1,2,3-tricarboxylic acid Formula: C12H20O7 MolecularWeight: 276.283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CCCC(CCC)(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C12H20O7/c1-3-5-11(6-4-2,9(15)16)12(19,10(17)18)7-8(13)14/h19H,3-7H2,1-2H3,(H,13,14)(H,15,16)(H,17,18)