hexyl ethanoate; 1,3,4,5,6-pentakis(oxidanyl)hexan-2-one

Systemtic Name: hexyl ethanoate; 1,3,4,5,6-pentakis(oxidanyl)hexan-2-one Openeye Name: hexyl acetate; 1,3,4,5,6-pentahydroxyhexan-2-one CAS Name: acetic acid hexyl ester; 1,3,4,5,6-pentahydroxy-2-hexanone IUPAC Name: hexyl acetate; 1,3,4,5,6-pentahydroxyhexan-2-one Traditional Name: acetic acid hexyl ester; 1,3,4,5,6-pentahydroxyhexan-2-one Formula: C14H28O8 MolecularWeight: 324.36732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C.C(C(C(C(C(=O)CO)O)O)O)O

Isomeric SMILES

CCCCCCOC(=O)C.C(C(C(C(C(=O)CO)O)O)O)O

InChI

InChI=1S/C8H16O2.C6H12O6/c1-3-4-5-6-7-10-8(2)9;7-1-3(9)5(11)6(12)4(10)2-8/h3-7H2,1-2H3;3,5-9,11-12H,1-2H2