3-(dioxidanylmethyl)-3-phosphono-hexanedioic acid

Systemtic Name: 3-(dioxidanylmethyl)-3-phosphono-hexanedioic acid Openeye Name: 3-(hydroperoxymethyl)-3-phosphono-hexanedioic acid CAS Name: 3-(hydroperoxymethyl)-3-phosphonohexanedioic acid IUPAC Name: 3-(hydroperoxymethyl)-3-phosphonohexanedioic acid Traditional Name: 3-(hydroperoxymethyl)-3-phosphono-adipic acid Formula: C7H13O9P MolecularWeight: 272.146481

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(CC(=O)O)(COO)P(=O)(O)O)C(=O)O

Isomeric SMILES

C(CC(CC(=O)O)(COO)P(=O)(O)O)C(=O)O

InChI

InChI=1S/C7H13O9P/c8-5(9)1-2-7(4-16-12,3-6(10)11)17(13,14)15/h12H,1-4H2,(H,8,9)(H,10,11)(H2,13,14,15)