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6-ethyloctan-3-yl octanoate

6-ethyloctan-3-yl octanoate

Systemtic Name:6-ethyloctan-3-yl octanoate
Openeye Name:1,4-diethylhexyl octanoate
CAS Name:octanoic acid 6-ethyloctan-3-yl ester
IUPAC Name:6-ethyloctan-3-yl octanoate
Traditional Name:caprylic acid 1,4-diethylhexyl ester
Formula: C18H36O2
MolecularWeight: 284.47724
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC(CC)CCC(CC)CC


Isomeric SMILES

CCCCCCCC(=O)OC(CC)CCC(CC)CC


InChI

InChI=1S/C18H36O2/c1-5-9-10-11-12-13-18(19)20-17(8-4)15-14-16(6-2)7-3/h16-17H,5-15H2,1-4H3


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