calcium magnesium 5-(1,2-dithiolan-3-yl)pentanoate diethanoate

Systemtic Name: calcium magnesium 5-(1,2-dithiolan-3-yl)pentanoate diethanoate Openeye Name: calcium magnesium 5-(dithiolan-3-yl)pentanoate diacetate CAS Name: calcium magnesium 5-(3-dithiolanyl)pentanoate diacetate IUPAC Name: calcium magnesium 5-(dithiolan-3-yl)pentanoate diacetate Traditional Name: calcium magnesium 5-(dithiolan-3-yl)valerate diacetate Formula: C20H32CaMgO8S4 MolecularWeight: 593.10628

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].CC(=O)[O-].C1CSSC1CCCCC(=O)[O-].C1CSSC1CCCCC(=O)[O-].[Mg+2].[Ca+2]

Isomeric SMILES

CC(=O)[O-].CC(=O)[O-].C1CSSC1CCCCC(=O)[O-].C1CSSC1CCCCC(=O)[O-].[Mg+2].[Ca+2]

InChI

InChI=1S/2C8H14O2S2.2C2H4O2.Ca.Mg/c2*9-8(10)4-2-1-3-7-5-6-11-12-7;2*1-2(3)4;;/h2*7H,1-6H2,(H,9,10);2*1H3,(H,3,4);;/q;;;;2*+2/p-4