[2,3,4-tris(oxidanyl)-5-oxidanylidene-hexyl] benzoate

Systemtic Name: [2,3,4-tris(oxidanyl)-5-oxidanylidene-hexyl] benzoate Openeye Name: (2,3,4-trihydroxy-5-oxo-hexyl) benzoate CAS Name: benzoic acid (2,3,4-trihydroxy-5-oxohexyl) ester IUPAC Name: (2,3,4-trihydroxy-5-oxohexyl) benzoate Traditional Name: benzoic acid (2,3,4-trihydroxy-5-keto-hexyl) ester Formula: C13H16O6 MolecularWeight: 268.26254

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(C(COC(=O)C1=CC=CC=C1)O)O)O

Isomeric SMILES

CC(=O)C(C(C(COC(=O)C1=CC=CC=C1)O)O)O

InChI

InChI=1S/C13H16O6/c1-8(14)11(16)12(17)10(15)7-19-13(18)9-5-3-2-4-6-9/h2-6,10-12,15-17H,7H2,1H3