2,2-dimethylpropyl 3,4,5-tris(chloranyl)benzoate

Systemtic Name: 2,2-dimethylpropyl 3,4,5-tris(chloranyl)benzoate Openeye Name: 2,2-dimethylpropyl 3,4,5-trichlorobenzoate CAS Name: 3,4,5-trichlorobenzoic acid 2,2-dimethylpropyl ester IUPAC Name: 2,2-dimethylpropyl 3,4,5-trichlorobenzoate Traditional Name: 3,4,5-trichlorobenzoic acid neopentyl ester Formula: C12H13Cl3O2 MolecularWeight: 295.58942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COC(=O)C1=CC(=C(C(=C1)Cl)Cl)Cl

Isomeric SMILES

CC(C)(C)COC(=O)C1=CC(=C(C(=C1)Cl)Cl)Cl

InChI

InChI=1S/C12H13Cl3O2/c1-12(2,3)6-17-11(16)7-4-8(13)10(15)9(14)5-7/h4-5H,6H2,1-3H3