[(1S,3R)-3-bromanyl-3,5,5-trimethyl-4-oxidanylidene-cyclohexyl] ethanoate

Systemtic Name: [(1S,3R)-3-bromanyl-3,5,5-trimethyl-4-oxidanylidene-cyclohexyl] ethanoate Openeye Name: [(1S,3R)-3-bromo-3,5,5-trimethyl-4-oxo-cyclohexyl] acetate CAS Name: acetic acid [(1S,3R)-3-bromo-3,5,5-trimethyl-4-oxocyclohexyl] ester IUPAC Name: [(1S,3R)-3-bromo-3,5,5-trimethyl-4-oxocyclohexyl] acetate Traditional Name: acetic acid [(1S,3R)-3-bromo-4-keto-3,5,5-trimethyl-cyclohexyl] ester Formula: C11H17BrO3 MolecularWeight: 277.15488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(C(=O)C(C1)(C)Br)(C)C

Isomeric SMILES

CC(=O)O[C@@H]1C[C@@](C(=O)C(C1)(C)C)(C)Br

InChI

InChI=1S/C11H17BrO3/c1-7(13)15-8-5-10(2,3)9(14)11(4,12)6-8/h8H,5-6H2,1-4H3/t8-,11+/m0/s1