propan-2-yl (2S,3R)-3-bromanyl-4-cyclohexyl-2-oxidanyl-butanoate

Systemtic Name: propan-2-yl (2S,3R)-3-bromanyl-4-cyclohexyl-2-oxidanyl-butanoate Openeye Name: isopropyl (2S,3R)-3-bromo-4-cyclohexyl-2-hydroxy-butanoate CAS Name: (2S,3R)-3-bromo-4-cyclohexyl-2-hydroxybutanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S,3R)-3-bromo-4-cyclohexyl-2-hydroxybutanoate Traditional Name: (2S,3R)-3-bromo-4-cyclohexyl-2-hydroxy-butyric acid isopropyl ester Formula: C13H23BrO3 MolecularWeight: 307.22392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C(CC1CCCCC1)Br)O

Isomeric SMILES

CC(C)OC(=O)[C@@H]([C@@H](CC1CCCCC1)Br)O

InChI

InChI=1S/C13H23BrO3/c1-9(2)17-13(16)12(15)11(14)8-10-6-4-3-5-7-10/h9-12,15H,3-8H2,1-2H3/t11-,12-/m1/s1