aluminum; 2-butyl-2-ethanoyl-hexanoate; propan-2-olate

Systemtic Name: aluminum; 2-butyl-2-ethanoyl-hexanoate; propan-2-olate Openeye Name: aluminum; 2-acetyl-2-butyl-hexanoate; propan-2-olate CAS Name: aluminum; 2-acetyl-2-butylhexanoate; 2-propanolate IUPAC Name: aluminum; 2-acetyl-2-butylhexanoate; propan-2-olate Traditional Name: aluminum; 2-acetyl-2-butyl-hexanoate; propan-2-olate Formula: C15H28AlO4+ MolecularWeight: 299.361958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22O3.C3H7O.Al/c1-4-6-8-12(10(3)13,11(14)15)9-7-5-2;1-3(2)4;/h4-9H2,1-3H3,(H,14,15);3H,1-2H3;/q;-1;+3/p-1