2,7-dimethyloct-7-en-5-yn-4-yl 2,3,4-tris(fluoranyl)benzoate

Systemtic Name: 2,7-dimethyloct-7-en-5-yn-4-yl 2,3,4-tris(fluoranyl)benzoate Openeye Name: (1-isobutyl-4-methyl-pent-4-en-2-ynyl) 2,3,4-trifluorobenzoate CAS Name: 2,3,4-trifluorobenzoic acid 2,7-dimethyloct-7-en-5-yn-4-yl ester IUPAC Name: 2,7-dimethyloct-7-en-5-yn-4-yl 2,3,4-trifluorobenzoate Traditional Name: 2,3,4-trifluorobenzoic acid (1-isobutyl-4-methyl-pent-4-en-2-ynyl) ester Formula: C17H17F3O2 MolecularWeight: 310.31089

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17F3O2/c1-10(2)5-6-12(9-11(3)4)22-17(21)13-7-8-14(18)16(20)15(13)19/h7-8,11-12H,1,9H2,2-4H3