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

Systemtic Name: 1-[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]-2-bromanyl-butan-1-one Openeye Name: 2-bromo-1-[3-(difluoromethoxy)-4-methoxy-phenyl]butan-1-one CAS Name: 2-bromo-1-[3-(difluoromethoxy)-4-methoxyphenyl]-1-butanone IUPAC Name: 2-bromo-1-[3-(difluoromethoxy)-4-methoxyphenyl]butan-1-one Traditional Name: 2-bromo-1-[3-(difluoromethoxy)-4-methoxy-phenyl]butan-1-one Formula: C12H13BrF2O3 MolecularWeight: 323.130626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13BrF2O3/c1-3-8(13)11(16)7-4-5-9(17-2)10(6-7)18-12(14)15/h4-6,8,12H,3H2,1-2H3