methyl (1R,5S)-3-bromanyl-2,2,4-trimethyl-5-oxidanyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl (1R,5S)-3-bromanyl-2,2,4-trimethyl-5-oxidanyl-cyclohex-3-ene-1-carboxylate Openeye Name: methyl (1R,5S)-3-bromo-5-hydroxy-2,2,4-trimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,5S)-3-bromo-5-hydroxy-2,2,4-trimethyl-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,5S)-3-bromo-5-hydroxy-2,2,4-trimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,5S)-3-bromo-5-hydroxy-2,2,4-trimethyl-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C11H17BrO3 MolecularWeight: 277.15488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(CC1O)C(=O)OC)(C)C)Br

Isomeric SMILES

CC1=C(C([C@@H](C[C@@H]1O)C(=O)OC)(C)C)Br

InChI

InChI=1S/C11H17BrO3/c1-6-8(13)5-7(10(14)15-4)11(2,3)9(6)12/h7-8,13H,5H2,1-4H3/t7-,8-/m0/s1