2-bromanyl-1-[3-methoxy-4-(trifluoromethyloxy)phenyl]butan-1-one

Systemtic Name: 2-bromanyl-1-[3-methoxy-4-(trifluoromethyloxy)phenyl]butan-1-one Openeye Name: 2-bromo-1-[3-methoxy-4-(trifluoromethoxy)phenyl]butan-1-one CAS Name: 2-bromo-1-[3-methoxy-4-(trifluoromethoxy)phenyl]-1-butanone IUPAC Name: 2-bromo-1-[3-methoxy-4-(trifluoromethoxy)phenyl]butan-1-one Traditional Name: 2-bromo-1-[3-methoxy-4-(trifluoromethoxy)phenyl]butan-1-one Formula: C12H12BrF3O3 MolecularWeight: 341.12109

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC(=C(C=C1)OC(F)(F)F)OC)Br

Isomeric SMILES

CCC(C(=O)C1=CC(=C(C=C1)OC(F)(F)F)OC)Br

InChI

InChI=1S/C12H12BrF3O3/c1-3-8(13)11(17)7-4-5-9(10(6-7)18-2)19-12(14,15)16/h4-6,8H,3H2,1-2H3