6-ethyloctan-3-yl 3-(trifluoromethyl)benzoate

Systemtic Name: 6-ethyloctan-3-yl 3-(trifluoromethyl)benzoate Openeye Name: 1,4-diethylhexyl 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid 6-ethyloctan-3-yl ester IUPAC Name: 6-ethyloctan-3-yl 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid 1,4-diethylhexyl ester Formula: C18H25F3O2 MolecularWeight: 330.38511

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CCC(CC)OC(=O)C1=CC(=CC=C1)C(F)(F)F

Isomeric SMILES

CCC(CC)CCC(CC)OC(=O)C1=CC(=CC=C1)C(F)(F)F

InChI

InChI=1S/C18H25F3O2/c1-4-13(5-2)10-11-16(6-3)23-17(22)14-8-7-9-15(12-14)18(19,20)21/h7-9,12-13,16H,4-6,10-11H2,1-3H3