aluminum 2-butyl-2-ethanoyl-hexanoate

Systemtic Name: aluminum 2-butyl-2-ethanoyl-hexanoate Openeye Name: aluminum 2-acetyl-2-butyl-hexanoate CAS Name: aluminum 2-acetyl-2-butylhexanoate IUPAC Name: aluminum 2-acetyl-2-butylhexanoate Traditional Name: aluminum 2-acetyl-2-butyl-hexanoate Formula: C36H63AlO9 MolecularWeight: 666.861558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(C(=O)C)C(=O)[O-].CCCCC(CCCC)(C(=O)C)C(=O)[O-].CCCCC(CCCC)(C(=O)C)C(=O)[O-].[Al+3]

Isomeric SMILES

CCCCC(CCCC)(C(=O)C)C(=O)[O-].CCCCC(CCCC)(C(=O)C)C(=O)[O-].CCCCC(CCCC)(C(=O)C)C(=O)[O-].[Al+3]

InChI

InChI=1S/3C12H22O3.Al/c3*1-4-6-8-12(10(3)13,11(14)15)9-7-5-2;/h3*4-9H2,1-3H3,(H,14,15);/q;;;+3/p-3