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

Systemtic Name: methyl (1R,2R)-3-bromanyl-4-methyl-2-oxidanyl-cyclohex-3-ene-1-carboxylate Openeye Name: methyl (1R,2R)-3-bromo-2-hydroxy-4-methyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,2R)-3-bromo-2-hydroxy-4-methyl-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,2R)-3-bromo-2-hydroxy-4-methylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,2R)-3-bromo-2-hydroxy-4-methyl-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C9H13BrO3 MolecularWeight: 249.10172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13BrO3/c1-5-3-4-6(9(12)13-2)8(11)7(5)10/h6,8,11H,3-4H2,1-2H3/t6-,8-/m1/s1