disodium 5-(5,5-disulfopentyldisulfanyl)pentane-1,1-disulfonate

Systemtic Name: disodium 5-(5,5-disulfopentyldisulfanyl)pentane-1,1-disulfonate Openeye Name: disodium 5-(5,5-disulfopentyldisulfanyl)pentane-1,1-disulfonate CAS Name: disodium 5-(5,5-disulfopentyldisulfanyl)pentane-1,1-disulfonate IUPAC Name: disodium 5-(5,5-disulfopentyldisulfanyl)pentane-1,1-disulfonate Traditional Name: disodium 5-(5,5-disulfopentyldisulfanyl)pentane-1,1-disulfonate Formula: C10H20Na2O12S6 MolecularWeight: 570.62814

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Descriptors Computed from Structure

Canonical SMILES:

C(CCSSCCCCC(S(=O)(=O)[O-])S(=O)(=O)[O-])CC(S(=O)(=O)O)S(=O)(=O)O.[Na+].[Na+]

Isomeric SMILES

C(CCSSCCCCC(S(=O)(=O)[O-])S(=O)(=O)[O-])CC(S(=O)(=O)O)S(=O)(=O)O.[Na+].[Na+]

InChI

InChI=1S/C10H22O12S6.2Na/c11-25(12,13)9(26(14,15)16)5-1-3-7-23-24-8-4-2-6-10(27(17,18)19)28(20,21)22;;/h9-10H,1-8H2,(H,11,12,13)(H,14,15,16)(H,17,18,19)(H,20,21,22);;/q;2*+1/p-2