1,2,4-tricarboxyoxypentan-2-ylphosphonic acid

Systemtic Name: 1,2,4-tricarboxyoxypentan-2-ylphosphonic acid Openeye Name: [1,3-dicarboxyoxy-1-(carboxyoxymethyl)butyl]phosphonic acid CAS Name: 1,2,4-tricarboxyoxypentan-2-ylphosphonic acid IUPAC Name: 1,2,4-tricarboxyoxypentan-2-ylphosphonic acid Traditional Name: [1,3-dicarboxyoxy-1-(carboxyoxymethyl)butyl]phosphonic acid Formula: C8H13O12P MolecularWeight: 332.155381

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(COC(=O)O)(OC(=O)O)P(=O)(O)O)OC(=O)O

Isomeric SMILES

CC(CC(COC(=O)O)(OC(=O)O)P(=O)(O)O)OC(=O)O

InChI

InChI=1S/C8H13O12P/c1-4(19-6(11)12)2-8(20-7(13)14,21(15,16)17)3-18-5(9)10/h4H,2-3H2,1H3,(H,9,10)(H,11,12)(H,13,14)(H2,15,16,17)