2-ethyl-2,4-dimethyl-3-phosphono-hexanedioic acid

Systemtic Name: 2-ethyl-2,4-dimethyl-3-phosphono-hexanedioic acid Openeye Name: 2-ethyl-2,4-dimethyl-3-phosphono-hexanedioic acid CAS Name: 2-ethyl-2,4-dimethyl-3-phosphonohexanedioic acid IUPAC Name: 2-ethyl-2,4-dimethyl-3-phosphonohexanedioic acid Traditional Name: 2-ethyl-2,4-dimethyl-3-phosphono-adipic acid Formula: C10H19O7P MolecularWeight: 282.227421

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H19O7P/c1-4-10(3,9(13)14)8(18(15,16)17)6(2)5-7(11)12/h6,8H,4-5H2,1-3H3,(H,11,12)(H,13,14)(H2,15,16,17)