hex-4-yn-3-yl 3-(trifluoromethyl)benzoate

Systemtic Name: hex-4-yn-3-yl 3-(trifluoromethyl)benzoate Openeye Name: 1-ethylbut-2-ynyl 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid hex-4-yn-3-yl ester IUPAC Name: hex-4-yn-3-yl 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid 1-ethylbut-2-ynyl ester Formula: C14H13F3O2 MolecularWeight: 270.24703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13F3O2/c1-3-6-12(4-2)19-13(18)10-7-5-8-11(9-10)14(15,16)17/h5,7-9,12H,4H2,1-2H3