3-phosphonoheptane-1,3,4-tricarboxylic acid

Systemtic Name: 3-phosphonoheptane-1,3,4-tricarboxylic acid Openeye Name: 3-phosphonoheptane-1,3,4-tricarboxylic acid CAS Name: 3-phosphonoheptane-1,3,4-tricarboxylic acid IUPAC Name: 3-phosphonoheptane-1,3,4-tricarboxylic acid Traditional Name: 3-phosphonoheptane-1,3,4-tricarboxylic acid Formula: C10H17O9P MolecularWeight: 312.210341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)C(CCC(=O)O)(C(=O)O)P(=O)(O)O

Isomeric SMILES

CCCC(C(=O)O)C(CCC(=O)O)(C(=O)O)P(=O)(O)O

InChI

InChI=1S/C10H17O9P/c1-2-3-6(8(13)14)10(9(15)16,20(17,18)19)5-4-7(11)12/h6H,2-5H2,1H3,(H,11,12)(H,13,14)(H,15,16)(H2,17,18,19)