calcium octadecanoate diethanoate

Systemtic Name: calcium octadecanoate diethanoate Openeye Name: calcium octadecanoate diacetate CAS Name: calcium octadecanoate diacetate IUPAC Name: calcium octadecanoate diacetate Traditional Name: calcium stearate diacetate Formula: C22H41CaO6- MolecularWeight: 441.63534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Ca+2]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Ca+2]

InChI

InChI=1S/C18H36O2.2C2H4O2.Ca/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;2*1-2(3)4;/h2-17H2,1H3,(H,19,20);2*1H3,(H,3,4);/q;;;+2/p-3