2-hexyl-2-(3-oxidanylpropyl)propanedioic acid

Systemtic Name: 2-hexyl-2-(3-oxidanylpropyl)propanedioic acid Openeye Name: 2-hexyl-2-(3-hydroxypropyl)propanedioic acid CAS Name: 2-hexyl-2-(3-hydroxypropyl)propanedioic acid IUPAC Name: 2-hexyl-2-(3-hydroxypropyl)propanedioic acid Traditional Name: 2-hexyl-2-(3-hydroxypropyl)malonic acid Formula: C12H22O5 MolecularWeight: 246.30008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCO)(C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCC(CCCO)(C(=O)O)C(=O)O

InChI

InChI=1S/C12H22O5/c1-2-3-4-5-7-12(10(14)15,11(16)17)8-6-9-13/h13H,2-9H2,1H3,(H,14,15)(H,16,17)