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

Systemtic Name: methyl 5-[(1R)-2-bromanyl-1-oxidanyl-ethyl]-2-phenylmethoxy-benzoate Openeye Name: methyl 2-benzyloxy-5-[(1R)-2-bromo-1-hydroxy-ethyl]benzoate CAS Name: 5-[(1R)-2-bromo-1-hydroxyethyl]-2-phenylmethoxybenzoic acid methyl ester IUPAC Name: methyl 5-[(1R)-2-bromo-1-hydroxyethyl]-2-phenylmethoxybenzoate Traditional Name: 2-benzoxy-5-[(1R)-2-bromo-1-hydroxy-ethyl]benzoic acid methyl ester Formula: C17H17BrO4 MolecularWeight: 365.21848

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)C(CBr)O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)[C@H](CBr)O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H17BrO4/c1-21-17(20)14-9-13(15(19)10-18)7-8-16(14)22-11-12-5-3-2-4-6-12/h2-9,15,19H,10-11H2,1H3/t15-/m0/s1