ethyl (2R,3S)-2-bromanyl-3-methyl-3-oxidanyl-4-phenyl-butanoate

Systemtic Name: ethyl (2R,3S)-2-bromanyl-3-methyl-3-oxidanyl-4-phenyl-butanoate Openeye Name: ethyl (2R,3S)-2-bromo-3-hydroxy-3-methyl-4-phenyl-butanoate CAS Name: (2R,3S)-2-bromo-3-hydroxy-3-methyl-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl (2R,3S)-2-bromo-3-hydroxy-3-methyl-4-phenylbutanoate Traditional Name: (2R,3S)-2-bromo-3-hydroxy-3-methyl-4-phenyl-butyric acid ethyl ester Formula: C13H17BrO3 MolecularWeight: 301.17628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)(CC1=CC=CC=C1)O)Br

Isomeric SMILES

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

InChI

InChI=1S/C13H17BrO3/c1-3-17-12(15)11(14)13(2,16)9-10-7-5-4-6-8-10/h4-8,11,16H,3,9H2,1-2H3/t11-,13-/m0/s1