[(1R,2R,6R)-2-bromanyl-6-oxidanyl-cyclohexyl] 2,2-dimethylpropanoate

Systemtic Name: [(1R,2R,6R)-2-bromanyl-6-oxidanyl-cyclohexyl] 2,2-dimethylpropanoate Openeye Name: [(1R,2R,6R)-2-bromo-6-hydroxy-cyclohexyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(1R,2R,6R)-2-bromo-6-hydroxycyclohexyl] ester IUPAC Name: [(1R,2R,6R)-2-bromo-6-hydroxycyclohexyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(1R,2R,6R)-2-bromo-6-hydroxy-cyclohexyl] ester Formula: C11H19BrO3 MolecularWeight: 279.17076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1C(CCCC1Br)O

Isomeric SMILES

CC(C)(C)C(=O)O[C@@H]1[C@@H](CCC[C@H]1Br)O

InChI

InChI=1S/C11H19BrO3/c1-11(2,3)10(14)15-9-7(12)5-4-6-8(9)13/h7-9,13H,4-6H2,1-3H3/t7-,8-,9+/m1/s1