hex-4-yn-3-yl 2,2,2-tris(chloranyl)ethanoate

Systemtic Name: hex-4-yn-3-yl 2,2,2-tris(chloranyl)ethanoate Openeye Name: 1-ethylbut-2-ynyl 2,2,2-trichloroacetate CAS Name: 2,2,2-trichloroacetic acid hex-4-yn-3-yl ester IUPAC Name: hex-4-yn-3-yl 2,2,2-trichloroacetate Traditional Name: 2,2,2-trichloroacetic acid 1-ethylbut-2-ynyl ester Formula: C8H9Cl3O2 MolecularWeight: 243.51486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H9Cl3O2/c1-3-5-6(4-2)13-7(12)8(9,10)11/h6H,4H2,1-2H3