[3-octanoyloxy-4,5-bis(oxidanyl)-1-oxidanylidene-pentan-2-yl] octanoate

Systemtic Name: [3-octanoyloxy-4,5-bis(oxidanyl)-1-oxidanylidene-pentan-2-yl] octanoate Openeye Name: (1-formyl-3,4-dihydroxy-2-octanoyloxy-butyl) octanoate CAS Name: octanoic acid [4,5-dihydroxy-1-oxo-3-(1-oxooctoxy)pentan-2-yl] ester IUPAC Name: (4,5-dihydroxy-3-octanoyloxy-1-oxopentan-2-yl) octanoate Traditional Name: caprylic acid (2-caprylyloxy-1-formyl-3,4-dihydroxy-butyl) ester Formula: C21H38O7 MolecularWeight: 402.52222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H38O7/c1-3-5-7-9-11-13-19(25)27-18(16-23)21(17(24)15-22)28-20(26)14-12-10-8-6-4-2/h16-18,21-22,24H,3-15H2,1-2H3