zinc; octadecanoate; propanoate

Systemtic Name: zinc; octadecanoate; propanoate Openeye Name: zinc; octadecanoate; propanoate CAS Name: zinc; octadecanoate; propanoate IUPAC Name: zinc; octadecanoate; propanoate Traditional Name: zinc; propionate; stearate Formula: C21H40O4Zn MolecularWeight: 421.9489

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)[O-].CCC(=O)[O-].[Zn+2]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)[O-].CCC(=O)[O-].[Zn+2]

InChI

InChI=1S/C18H36O2.C3H6O2.Zn/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-2-3(4)5;/h2-17H2,1H3,(H,19,20);2H2,1H3,(H,4,5);/q;;+2/p-2