tetradecan-3-yl 3-(trifluoromethyl)benzoate

Systemtic Name: tetradecan-3-yl 3-(trifluoromethyl)benzoate Openeye Name: 1-ethyldodecyl 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid tetradecan-3-yl ester IUPAC Name: tetradecan-3-yl 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid 1-ethyldodecyl ester Formula: C22H33F3O2 MolecularWeight: 386.49143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H33F3O2/c1-3-5-6-7-8-9-10-11-12-16-20(4-2)27-21(26)18-14-13-15-19(17-18)22(23,24)25/h13-15,17,20H,3-12,16H2,1-2H3