[(1S,2S,6R)-2-bromanyl-4-methoxycarbonyl-6-oxidanyl-cyclohex-3-en-1-yl] benzoate

Systemtic Name: [(1S,2S,6R)-2-bromanyl-4-methoxycarbonyl-6-oxidanyl-cyclohex-3-en-1-yl] benzoate Openeye Name: [(1S,2S,6R)-2-bromo-6-hydroxy-4-methoxycarbonyl-cyclohex-3-en-1-yl] benzoate CAS Name: benzoic acid [(1S,2S,6R)-2-bromo-6-hydroxy-4-methoxycarbonyl-1-cyclohex-3-enyl] ester IUPAC Name: [(1S,2S,6R)-2-bromo-6-hydroxy-4-methoxycarbonylcyclohex-3-en-1-yl] benzoate Traditional Name: benzoic acid [(1S,2S,6R)-2-bromo-4-carbomethoxy-6-hydroxy-cyclohex-3-en-1-yl] ester Formula: C15H15BrO5 MolecularWeight: 355.1806

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(C(C(C1)O)OC(=O)C2=CC=CC=C2)Br

Isomeric SMILES

COC(=O)C1=C[C@@H]([C@H]([C@@H](C1)O)OC(=O)C2=CC=CC=C2)Br

InChI

InChI=1S/C15H15BrO5/c1-20-14(18)10-7-11(16)13(12(17)8-10)21-15(19)9-5-3-2-4-6-9/h2-7,11-13,17H,8H2,1H3/t11-,12+,13+/m0/s1