3-phosphonohexane-1,2,3-tricarboxylic acid

Systemtic Name: 3-phosphonohexane-1,2,3-tricarboxylic acid Openeye Name: 3-phosphonohexane-1,2,3-tricarboxylic acid CAS Name: 3-phosphonohexane-1,2,3-tricarboxylic acid IUPAC Name: 3-phosphonohexane-1,2,3-tricarboxylic acid Traditional Name: 3-phosphonohexane-1,2,3-tricarboxylic acid Formula: C9H15O9P MolecularWeight: 298.183761

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC(=O)O)C(=O)O)(C(=O)O)P(=O)(O)O

Isomeric SMILES

CCCC(C(CC(=O)O)C(=O)O)(C(=O)O)P(=O)(O)O

InChI

InChI=1S/C9H15O9P/c1-2-3-9(8(14)15,19(16,17)18)5(7(12)13)4-6(10)11/h5H,2-4H2,1H3,(H,10,11)(H,12,13)(H,14,15)(H2,16,17,18)