2-acetyloxy-5-bromanyl-3-iodanyl-benzoate

Systemtic Name: 2-acetyloxy-5-bromanyl-3-iodanyl-benzoate Openeye Name: 2-acetoxy-5-bromo-3-iodo-benzoate CAS Name: 2-acetyloxy-5-bromo-3-iodobenzoate IUPAC Name: 2-acetyloxy-5-bromo-3-iodobenzoate Traditional Name: 2-acetoxy-5-bromo-3-iodo-benzoate Formula: C9H5BrIO4- MolecularWeight: 383.94207

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1C(=O)[O-])Br)I

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1C(=O)[O-])Br)I

InChI

InChI=1S/C9H6BrIO4/c1-4(12)15-8-6(9(13)14)2-5(10)3-7(8)11/h2-3H,1H3,(H,13,14)/p-1