[3-octanoyloxy-4,5,6-tris(oxidanyl)-2-oxidanylidene-hexyl] octanoate

Systemtic Name: [3-octanoyloxy-4,5,6-tris(oxidanyl)-2-oxidanylidene-hexyl] octanoate Openeye Name: (4,5,6-trihydroxy-3-octanoyloxy-2-oxo-hexyl) octanoate CAS Name: octanoic acid [4,5,6-trihydroxy-2-oxo-3-(1-oxooctoxy)hexyl] ester IUPAC Name: (4,5,6-trihydroxy-3-octanoyloxy-2-oxohexyl) octanoate Traditional Name: caprylic acid (3-caprylyloxy-4,5,6-trihydroxy-2-keto-hexyl) ester Formula: C22H40O8 MolecularWeight: 432.5482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC(=O)C(C(C(CO)O)O)OC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCC(=O)OCC(=O)C(C(C(CO)O)O)OC(=O)CCCCCCC

InChI

InChI=1S/C22H40O8/c1-3-5-7-9-11-13-19(26)29-16-18(25)22(21(28)17(24)15-23)30-20(27)14-12-10-8-6-4-2/h17,21-24,28H,3-16H2,1-2H3