barium(2+); 3,4-bis(bromanyl)benzoate

Systemtic Name: barium(2+); 3,4-bis(bromanyl)benzoate Openeye Name: barium(2+); 3,4-dibromobenzoate CAS Name: barium(2+); 3,4-dibromobenzoate IUPAC Name: barium(2+); 3,4-dibromobenzoate Traditional Name: barium(2+); 3,4-dibromobenzoate Formula: C14H6BaBr4O4 MolecularWeight: 695.13804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)[O-])Br)Br.C1=CC(=C(C=C1C(=O)[O-])Br)Br.[Ba+2]

Isomeric SMILES

C1=CC(=C(C=C1C(=O)[O-])Br)Br.C1=CC(=C(C=C1C(=O)[O-])Br)Br.[Ba+2]

InChI

InChI=1S/2C7H4Br2O2.Ba/c2*8-5-2-1-4(7(10)11)3-6(5)9;/h2*1-3H,(H,10,11);/q;;+2/p-2