[2-(butanoyloxymethyl)-2-(hydroxymethyl)-3-oxidanyl-propyl] hexanoate

Systemtic Name: [2-(butanoyloxymethyl)-2-(hydroxymethyl)-3-oxidanyl-propyl] hexanoate Openeye Name: [2-(butanoyloxymethyl)-3-hydroxy-2-(hydroxymethyl)propyl] hexanoate CAS Name: hexanoic acid [2,2-bis(hydroxymethyl)-3-(1-oxobutoxy)propyl] ester IUPAC Name: [2-(butanoyloxymethyl)-3-hydroxy-2-(hydroxymethyl)propyl] hexanoate Traditional Name: hexanoic acid [2-(butyryloxymethyl)-3-hydroxy-2-methylol-propyl] ester Formula: C15H28O6 MolecularWeight: 304.37922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCC(CO)(CO)COC(=O)CCC

Isomeric SMILES

CCCCCC(=O)OCC(CO)(CO)COC(=O)CCC

InChI

InChI=1S/C15H28O6/c1-3-5-6-8-14(19)21-12-15(9-16,10-17)11-20-13(18)7-4-2/h16-17H,3-12H2,1-2H3