3-acetyloxy-4,4,4-tris(chloranyl)butanoic acid

Systemtic Name: 3-acetyloxy-4,4,4-tris(chloranyl)butanoic acid Openeye Name: 3-acetoxy-4,4,4-trichloro-butanoic acid CAS Name: 3-acetyloxy-4,4,4-trichlorobutanoic acid IUPAC Name: 3-acetyloxy-4,4,4-trichlorobutanoic acid Traditional Name: 3-acetoxy-4,4,4-trichloro-butyric acid Formula: C6H7Cl3O4 MolecularWeight: 249.47638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H7Cl3O4/c1-3(10)13-4(2-5(11)12)6(7,8)9/h4H,2H2,1H3,(H,11,12)