dialuminum 2-acetyloxy-3-oxidanyl-butanedioate

Systemtic Name: dialuminum 2-acetyloxy-3-oxidanyl-butanedioate Openeye Name: dialuminum 2-acetoxy-3-hydroxy-butanedioate CAS Name: dialuminum 2-acetyloxy-3-hydroxybutanedioate IUPAC Name: dialuminum 2-acetyloxy-3-hydroxybutanedioate Traditional Name: dialuminum 2-acetoxy-3-hydroxy-succinate Formula: C18H18Al2O21 MolecularWeight: 624.285996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C6H8O7.2Al/c3*1-2(7)13-4(6(11)12)3(8)5(9)10;;/h3*3-4,8H,1H3,(H,9,10)(H,11,12);;/q;;;2*+3/p-6