3-bromanyl-5-ethoxy-4-(2-oxidanylideneoxolan-3-yl)oxy-benzoic acid

Systemtic Name: 3-bromanyl-5-ethoxy-4-(2-oxidanylideneoxolan-3-yl)oxy-benzoic acid Openeye Name: 3-bromo-5-ethoxy-4-(2-oxotetrahydrofuran-3-yl)oxy-benzoic acid CAS Name: 3-bromo-5-ethoxy-4-[(2-oxo-3-oxolanyl)oxy]benzoic acid IUPAC Name: 3-bromo-5-ethoxy-4-(2-oxooxolan-3-yl)oxybenzoic acid Traditional Name: 3-bromo-5-ethoxy-4-(2-ketotetrahydrofuran-3-yl)oxy-benzoic acid Formula: C13H13BrO6 MolecularWeight: 345.14272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)O)Br)OC2CCOC2=O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)O)Br)OC2CCOC2=O

InChI

InChI=1S/C13H13BrO6/c1-2-18-10-6-7(12(15)16)5-8(14)11(10)20-9-3-4-19-13(9)17/h5-6,9H,2-4H2,1H3,(H,15,16)