1-bromanyl-1-(4-chloranyl-2-methyl-phenoxy)-3,3-dimethyl-butan-2-one

Systemtic Name: 1-bromanyl-1-(4-chloranyl-2-methyl-phenoxy)-3,3-dimethyl-butan-2-one Openeye Name: 1-bromo-1-(4-chloro-2-methyl-phenoxy)-3,3-dimethyl-butan-2-one CAS Name: 1-bromo-1-(4-chloro-2-methylphenoxy)-3,3-dimethyl-2-butanone IUPAC Name: 1-bromo-1-(4-chloro-2-methylphenoxy)-3,3-dimethylbutan-2-one Traditional Name: 1-bromo-1-(4-chloro-2-methyl-phenoxy)-3,3-dimethyl-butan-2-one Formula: C13H16BrClO2 MolecularWeight: 319.62194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC(C(=O)C(C)(C)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC(C(=O)C(C)(C)C)Br

InChI

InChI=1S/C13H16BrClO2/c1-8-7-9(15)5-6-10(8)17-12(14)11(16)13(2,3)4/h5-7,12H,1-4H3