pentan-3-yl hexadecanoate

Systemtic Name: pentan-3-yl hexadecanoate Openeye Name: 1-ethylpropyl hexadecanoate CAS Name: hexadecanoic acid pentan-3-yl ester IUPAC Name: pentan-3-yl hexadecanoate Traditional Name: palmitic acid 1-ethylpropyl ester Formula: C21H42O2 MolecularWeight: 326.55698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(CC)CC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC(CC)CC

InChI

InChI=1S/C21H42O2/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-21(22)23-20(5-2)6-3/h20H,4-19H2,1-3H3