aluminum 4-(2-oxidanidyl-2-oxidanylidene-ethyl)benzoate

Systemtic Name: aluminum 4-(2-oxidanidyl-2-oxidanylidene-ethyl)benzoate Openeye Name: aluminum 4-(2-oxido-2-oxo-ethyl)benzoate CAS Name: aluminum 4-(2-oxido-2-oxoethyl)benzoate IUPAC Name: aluminum 4-(2-oxido-2-oxoethyl)benzoate Traditional Name: aluminum 4-(2-keto-2-oxido-ethyl)benzoate Formula: C27H18AlO12-3 MolecularWeight: 561.406158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)[O-])C(=O)[O-].C1=CC(=CC=C1CC(=O)[O-])C(=O)[O-].C1=CC(=CC=C1CC(=O)[O-])C(=O)[O-].[Al+3]

Isomeric SMILES

C1=CC(=CC=C1CC(=O)[O-])C(=O)[O-].C1=CC(=CC=C1CC(=O)[O-])C(=O)[O-].C1=CC(=CC=C1CC(=O)[O-])C(=O)[O-].[Al+3]

InChI

InChI=1S/3C9H8O4.Al/c3*10-8(11)5-6-1-3-7(4-2-6)9(12)13;/h3*1-4H,5H2,(H,10,11)(H,12,13);/q;;;+3/p-6