methyl (2S)-2-bromanyl-3-[3-(trifluoromethyl)phenyl]propanoate

Systemtic Name: methyl (2S)-2-bromanyl-3-[3-(trifluoromethyl)phenyl]propanoate Openeye Name: methyl (2S)-2-bromo-3-[3-(trifluoromethyl)phenyl]propanoate CAS Name: (2S)-2-bromo-3-[3-(trifluoromethyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-bromo-3-[3-(trifluoromethyl)phenyl]propanoate Traditional Name: (2S)-2-bromo-3-[3-(trifluoromethyl)phenyl]propionic acid methyl ester Formula: C11H10BrF3O2 MolecularWeight: 311.09511

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC(=CC=C1)C(F)(F)F)Br

Isomeric SMILES

COC(=O)[C@H](CC1=CC(=CC=C1)C(F)(F)F)Br

InChI

InChI=1S/C11H10BrF3O2/c1-17-10(16)9(12)6-7-3-2-4-8(5-7)11(13,14)15/h2-5,9H,6H2,1H3/t9-/m0/s1