2-bromanyl-1-[3-methoxy-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]butan-1-one

Systemtic Name: 2-bromanyl-1-[3-methoxy-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]butan-1-one Openeye Name: 2-bromo-1-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]butan-1-one CAS Name: 2-bromo-1-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]-1-butanone IUPAC Name: 2-bromo-1-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]butan-1-one Traditional Name: 2-bromo-1-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]butan-1-one Formula: C13H14BrF3O3 MolecularWeight: 355.14767

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14BrF3O3/c1-3-9(14)12(18)8-4-5-10(11(6-8)19-2)20-7-13(15,16)17/h4-6,9H,3,7H2,1-2H3