2,7-dimethyloct-7-en-5-yn-4-yl 2,2,2-tris(chloranyl)ethanoate

Systemtic Name: 2,7-dimethyloct-7-en-5-yn-4-yl 2,2,2-tris(chloranyl)ethanoate Openeye Name: (1-isobutyl-4-methyl-pent-4-en-2-ynyl) 2,2,2-trichloroacetate CAS Name: 2,2,2-trichloroacetic acid 2,7-dimethyloct-7-en-5-yn-4-yl ester IUPAC Name: 2,7-dimethyloct-7-en-5-yn-4-yl 2,2,2-trichloroacetate Traditional Name: 2,2,2-trichloroacetic acid (1-isobutyl-4-methyl-pent-4-en-2-ynyl) ester Formula: C12H15Cl3O2 MolecularWeight: 297.6053

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C#CC(=C)C)OC(=O)C(Cl)(Cl)Cl

Isomeric SMILES

CC(C)CC(C#CC(=C)C)OC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C12H15Cl3O2/c1-8(2)5-6-10(7-9(3)4)17-11(16)12(13,14)15/h9-10H,1,7H2,2-4H3