dialuminum benzene-1,3-dicarboxylate

Systemtic Name: dialuminum benzene-1,3-dicarboxylate Openeye Name: dialuminum benzene-1,3-dicarboxylate CAS Name: dialuminum benzene-1,3-dicarboxylate IUPAC Name: dialuminum benzene-1,3-dicarboxylate Traditional Name: dialuminum isophthalate Formula: C24H12Al2O12 MolecularWeight: 546.307956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)[O-])C(=O)[O-].C1=CC(=CC(=C1)C(=O)[O-])C(=O)[O-].C1=CC(=CC(=C1)C(=O)[O-])C(=O)[O-].[Al+3].[Al+3]

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)[O-])C(=O)[O-].C1=CC(=CC(=C1)C(=O)[O-])C(=O)[O-].C1=CC(=CC(=C1)C(=O)[O-])C(=O)[O-].[Al+3].[Al+3]

InChI

InChI=1S/3C8H6O4.2Al/c3*9-7(10)5-2-1-3-6(4-5)8(11)12;;/h3*1-4H,(H,9,10)(H,11,12);;/q;;;2*+3/p-6