aluminum; 2-(2-azanyl-2-oxidanylidene-ethyl)tetradecanoic acid; octadecanoate

Systemtic Name: aluminum; 2-(2-azanyl-2-oxidanylidene-ethyl)tetradecanoic acid; octadecanoate Openeye Name: aluminum; 2-(2-amino-2-oxo-ethyl)tetradecanoic acid; octadecanoate CAS Name: aluminum; 2-(2-amino-2-oxoethyl)tetradecanoic acid; octadecanoate IUPAC Name: aluminum; 2-(2-amino-2-oxoethyl)tetradecanoic acid; octadecanoate Traditional Name: aluminum; 2-(2-amino-2-keto-ethyl)myristic acid; stearate Formula: C70H136AlNO9 MolecularWeight: 1162.811678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C18H36O2.C16H31NO3.Al/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-2-3-4-5-6-7-8-9-10-11-12-14(16(19)20)13-15(17)18;/h3*2-17H2,1H3,(H,19,20);14H,2-13H2,1H3,(H2,17,18)(H,19,20);/q;;;;+3/p-3