1-chloranyl-3,3-dimethyl-1-[2,3,6-tris(chloranyl)phenoxy]butan-2-one

Systemtic Name: 1-chloranyl-3,3-dimethyl-1-[2,3,6-tris(chloranyl)phenoxy]butan-2-one Openeye Name: 1-chloro-3,3-dimethyl-1-(2,3,6-trichlorophenoxy)butan-2-one CAS Name: 1-chloro-3,3-dimethyl-1-(2,3,6-trichlorophenoxy)-2-butanone IUPAC Name: 1-chloro-3,3-dimethyl-1-(2,3,6-trichlorophenoxy)butan-2-one Traditional Name: 1-chloro-3,3-dimethyl-1-(2,3,6-trichlorophenoxy)butan-2-one Formula: C12H12Cl4O2 MolecularWeight: 330.03448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(OC1=C(C=CC(=C1Cl)Cl)Cl)Cl

Isomeric SMILES

CC(C)(C)C(=O)C(OC1=C(C=CC(=C1Cl)Cl)Cl)Cl

InChI

InChI=1S/C12H12Cl4O2/c1-12(2,3)10(17)11(16)18-9-7(14)5-4-6(13)8(9)15/h4-5,11H,1-3H3