[(1S,2R,5S,6R)-6-bromanyl-2-chloranyl-5-oxidanyl-cyclohex-3-en-1-yl] ethanoate

Systemtic Name: [(1S,2R,5S,6R)-6-bromanyl-2-chloranyl-5-oxidanyl-cyclohex-3-en-1-yl] ethanoate Openeye Name: [(1S,2R,5S,6R)-6-bromo-2-chloro-5-hydroxy-cyclohex-3-en-1-yl] acetate CAS Name: acetic acid [(1S,2R,5S,6R)-6-bromo-2-chloro-5-hydroxy-1-cyclohex-3-enyl] ester IUPAC Name: [(1S,2R,5S,6R)-6-bromo-2-chloro-5-hydroxycyclohex-3-en-1-yl] acetate Traditional Name: acetic acid [(1S,2R,5S,6R)-6-bromo-2-chloro-5-hydroxy-cyclohex-3-en-1-yl] ester Formula: C8H10BrClO3 MolecularWeight: 269.5202

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C=CC(C1Br)O)Cl

Isomeric SMILES

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

InChI

InChI=1S/C8H10BrClO3/c1-4(11)13-8-5(10)2-3-6(12)7(8)9/h2-3,5-8,12H,1H3/t5-,6+,7-,8+/m1/s1