sodium zinc 2-[6,8-bis(sulfanyl)octanoylamino]propanoate

Systemtic Name: sodium zinc 2-[6,8-bis(sulfanyl)octanoylamino]propanoate Openeye Name: sodium zinc 2-[6,8-bis(sulfanyl)octanoylamino]propanoate CAS Name: sodium zinc 2-[(6,8-dimercapto-1-oxooctyl)amino]propanoate IUPAC Name: sodium zinc 2-[6,8-bis(sulfanyl)octanoylamino]propanoate Traditional Name: sodium zinc 2-(6,8-dimercaptooctanoylamino)propionate Formula: C22H40N2NaO6S4Zn+ MolecularWeight: 645.22157

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)CCCCC(CCS)S.CC(C(=O)[O-])NC(=O)CCCCC(CCS)S.[Na+].[Zn+2]

Isomeric SMILES

CC(C(=O)[O-])NC(=O)CCCCC(CCS)S.CC(C(=O)[O-])NC(=O)CCCCC(CCS)S.[Na+].[Zn+2]

InChI

InChI=1S/2C11H21NO3S2.Na.Zn/c2*1-8(11(14)15)12-10(13)5-3-2-4-9(17)6-7-16;;/h2*8-9,16-17H,2-7H2,1H3,(H,12,13)(H,14,15);;/q;;+1;+2/p-2