disodium 2-dodecylsulfanyl-3-oxidanyl-butanedioate

Systemtic Name: disodium 2-dodecylsulfanyl-3-oxidanyl-butanedioate Openeye Name: disodium 2-dodecylsulfanyl-3-hydroxy-butanedioate CAS Name: disodium 2-(dodecylthio)-3-hydroxybutanedioate IUPAC Name: disodium 2-dodecylsulfanyl-3-hydroxybutanedioate Traditional Name: disodium 2-hydroxy-3-(laurylthio)succinate Formula: C16H28Na2O5S MolecularWeight: 378.43506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(C(C(=O)[O-])O)C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCCCCCCCCCCCSC(C(C(=O)[O-])O)C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C16H30O5S.2Na/c1-2-3-4-5-6-7-8-9-10-11-12-22-14(16(20)21)13(17)15(18)19;;/h13-14,17H,2-12H2,1H3,(H,18,19)(H,20,21);;/q;2*+1/p-2