aluminum 4,4-dibutoxy-2-ethanoyl-butanoate

Systemtic Name: aluminum 4,4-dibutoxy-2-ethanoyl-butanoate Openeye Name: aluminum 2-acetyl-4,4-dibutoxy-butanoate CAS Name: aluminum 2-acetyl-4,4-dibutoxybutanoate IUPAC Name: aluminum 2-acetyl-4,4-dibutoxybutanoate Traditional Name: aluminum 2-acetyl-4,4-dibutoxy-butyrate Formula: C42H75AlO15 MolecularWeight: 847.017438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C14H26O5.Al/c3*1-4-6-8-18-13(19-9-7-5-2)10-12(11(3)15)14(16)17;/h3*12-13H,4-10H2,1-3H3,(H,16,17);/q;;;+3/p-3