calcium; lithium; manganese(2+); octadecanoate; diethanoate

Systemtic Name: calcium; lithium; manganese(2+); octadecanoate; diethanoate Openeye Name: calcium lithium manganous octadecanoate diacetate CAS Name: calcium; lithium; manganese(2+); octadecanoate; diacetate IUPAC Name: calcium; lithium; manganese(2+); octadecanoate; diacetate Traditional Name: calcium lithium manganous stearate diacetate Formula: C58H111CaLiMnO10 MolecularWeight: 1070.452989

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C18H36O2.2C2H4O2.Ca.Li.Mn/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;2*1-2(3)4;;;/h3*2-17H2,1H3,(H,19,20);2*1H3,(H,3,4);;;/q;;;;;+2;+1;+2/p-5