ethyl 5-bromanyl-2-oxidanyl-3-propanoyl-benzoate

Systemtic Name: ethyl 5-bromanyl-2-oxidanyl-3-propanoyl-benzoate Openeye Name: ethyl 5-bromo-2-hydroxy-3-propanoyl-benzoate CAS Name: 5-bromo-2-hydroxy-3-(1-oxopropyl)benzoic acid ethyl ester IUPAC Name: ethyl 5-bromo-2-hydroxy-3-propanoylbenzoate Traditional Name: 5-bromo-2-hydroxy-3-propionyl-benzoic acid ethyl ester Formula: C12H13BrO4 MolecularWeight: 301.13322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=CC(=C1O)C(=O)OCC)Br

Isomeric SMILES

CCC(=O)C1=CC(=CC(=C1O)C(=O)OCC)Br

InChI

InChI=1S/C12H13BrO4/c1-3-10(14)8-5-7(13)6-9(11(8)15)12(16)17-4-2/h5-6,15H,3-4H2,1-2H3