2,5-dimethyl-3-phosphono-hexanedioic acid

Systemtic Name: 2,5-dimethyl-3-phosphono-hexanedioic acid Openeye Name: 2,5-dimethyl-3-phosphono-hexanedioic acid CAS Name: 2,5-dimethyl-3-phosphonohexanedioic acid IUPAC Name: 2,5-dimethyl-3-phosphonohexanedioic acid Traditional Name: 2,5-dimethyl-3-phosphono-adipic acid Formula: C8H15O7P MolecularWeight: 254.174261

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H15O7P/c1-4(7(9)10)3-6(16(13,14)15)5(2)8(11)12/h4-6H,3H2,1-2H3,(H,9,10)(H,11,12)(H2,13,14,15)