methyl 5-[(1R)-2-bromanyl-1-oxidanyl-ethyl]-2-(2-phenylethanoyloxy)benzoate

Systemtic Name: methyl 5-[(1R)-2-bromanyl-1-oxidanyl-ethyl]-2-(2-phenylethanoyloxy)benzoate Openeye Name: methyl 5-[(1R)-2-bromo-1-hydroxy-ethyl]-2-(2-phenylacetyl)oxy-benzoate CAS Name: 5-[(1R)-2-bromo-1-hydroxyethyl]-2-(1-oxo-2-phenylethoxy)benzoic acid methyl ester IUPAC Name: methyl 5-[(1R)-2-bromo-1-hydroxyethyl]-2-(2-phenylacetyl)oxybenzoate Traditional Name: 5-[(1R)-2-bromo-1-hydroxy-ethyl]-2-(2-phenylacetyl)oxy-benzoic acid methyl ester Formula: C18H17BrO5 MolecularWeight: 393.22858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)C(CBr)O)OC(=O)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)[C@H](CBr)O)OC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C18H17BrO5/c1-23-18(22)14-10-13(15(20)11-19)7-8-16(14)24-17(21)9-12-5-3-2-4-6-12/h2-8,10,15,20H,9,11H2,1H3/t15-/m0/s1