methyl 4-bromanyl-6,6,6-tris(fluoranyl)-3,3-dimethyl-hexanoate

Systemtic Name: methyl 4-bromanyl-6,6,6-tris(fluoranyl)-3,3-dimethyl-hexanoate Openeye Name: methyl 4-bromo-6,6,6-trifluoro-3,3-dimethyl-hexanoate CAS Name: 4-bromo-6,6,6-trifluoro-3,3-dimethylhexanoic acid methyl ester IUPAC Name: methyl 4-bromo-6,6,6-trifluoro-3,3-dimethylhexanoate Traditional Name: 4-bromo-6,6,6-trifluoro-3,3-dimethyl-hexanoic acid methyl ester Formula: C9H14BrF3O2 MolecularWeight: 291.10547

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14BrF3O2/c1-8(2,5-7(14)15-3)6(10)4-9(11,12)13/h6H,4-5H2,1-3H3