dodecyl(ethanoyl)alumanylium; propanoate

Systemtic Name: dodecyl(ethanoyl)alumanylium; propanoate Openeye Name: acetyl(dodecyl)alumanylium; propanoate CAS Name: acetyl(dodecyl)alumanylium; propanoate IUPAC Name: acetyl(dodecyl)alumanylium; propanoate Traditional Name: acetyl(lauryl)alumanylium; propionate Formula: C20H38AlO5- MolecularWeight: 385.494258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[Al+]C(=O)C.CCC(=O)[O-].CCC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC[Al+]C(=O)C.CCC(=O)[O-].CCC(=O)[O-]

InChI

InChI=1S/C12H25.2C3H6O2.C2H3O.Al/c1-3-5-7-9-11-12-10-8-6-4-2;2*1-2-3(4)5;1-2-3;/h1,3-12H2,2H3;2*2H2,1H3,(H,4,5);1H3;/q;;;;+1/p-2