aluminum 4-(carboxymethyl)benzoate

Systemtic Name: aluminum 4-(carboxymethyl)benzoate Openeye Name: aluminum 4-(carboxymethyl)benzoate CAS Name: aluminum 4-(carboxymethyl)benzoate IUPAC Name: aluminum 4-(carboxymethyl)benzoate Traditional Name: aluminum 4-(carboxymethyl)benzoate Formula: C27H21AlO12 MolecularWeight: 564.429978

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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-3