mercury(2+); 4-methoxy-3-(8-oxidanyl-8-oxidanylidene-octyl)dodecanoate

Systemtic Name: mercury(2+); 4-methoxy-3-(8-oxidanyl-8-oxidanylidene-octyl)dodecanoate Openeye Name: mercuric 3-(8-hydroxy-8-oxo-octyl)-4-methoxy-dodecanoate CAS Name: 3-(8-hydroxy-8-oxooctyl)-4-methoxydodecanoate; mercury(2+) IUPAC Name: 3-(8-hydroxy-8-oxooctyl)-4-methoxydodecanoate; mercury(2+) Traditional Name: mercuric 3-(8-hydroxy-8-keto-octyl)-4-methoxy-laurate Formula: C42H78HgO10 MolecularWeight: 943.65272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(CCCCCCCC(=O)O)CC(=O)[O-])OC.CCCCCCCCC(C(CCCCCCCC(=O)O)CC(=O)[O-])OC.[Hg+2]

Isomeric SMILES

CCCCCCCCC(C(CCCCCCCC(=O)O)CC(=O)[O-])OC.CCCCCCCCC(C(CCCCCCCC(=O)O)CC(=O)[O-])OC.[Hg+2]

InChI

InChI=1S/2C21H40O5.Hg/c2*1-3-4-5-6-9-12-15-19(26-2)18(17-21(24)25)14-11-8-7-10-13-16-20(22)23;/h2*18-19H,3-17H2,1-2H3,(H,22,23)(H,24,25);/q;;+2/p-2