aluminum octadecanoate benzoate

Systemtic Name: aluminum octadecanoate benzoate Openeye Name: aluminum octadecanoate benzoate CAS Name: aluminum octadecanoate benzoate IUPAC Name: aluminum octadecanoate benzoate Traditional Name: aluminum stearate benzoate Formula: C25H40AlO4+ MolecularWeight: 431.564238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Al+3]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Al+3]

InChI

InChI=1S/C18H36O2.C7H6O2.Al/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;8-7(9)6-4-2-1-3-5-6;/h2-17H2,1H3,(H,19,20);1-5H,(H,8,9);/q;;+3/p-2