4-chloranylbutan-2-yl 2,2,2-tris(chloranyl)ethanoate

Systemtic Name: 4-chloranylbutan-2-yl 2,2,2-tris(chloranyl)ethanoate Openeye Name: (3-chloro-1-methyl-propyl) 2,2,2-trichloroacetate CAS Name: 2,2,2-trichloroacetic acid 4-chlorobutan-2-yl ester IUPAC Name: 4-chlorobutan-2-yl 2,2,2-trichloroacetate Traditional Name: 2,2,2-trichloroacetic acid (3-chloro-1-methyl-propyl) ester Formula: C6H8Cl4O2 MolecularWeight: 253.93852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H8Cl4O2/c1-4(2-3-7)12-5(11)6(8,9)10/h4H,2-3H2,1H3