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2-hexylsulfanyl-2-oxidanyl-butanedioate

2-hexylsulfanyl-2-oxidanyl-butanedioate

Systemtic Name:2-hexylsulfanyl-2-oxidanyl-butanedioate
Openeye Name:2-hexylsulfanyl-2-hydroxy-butanedioate
CAS Name:2-(hexylthio)-2-hydroxybutanedioate
IUPAC Name:2-hexylsulfanyl-2-hydroxybutanedioate
Traditional Name:2-(hexylthio)-2-hydroxy-succinate
Formula: C10H16O5S-2
MolecularWeight: 248.29604
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC(CC(=O)[O-])(C(=O)[O-])O


Isomeric SMILES

CCCCCCSC(CC(=O)[O-])(C(=O)[O-])O


InChI

InChI=1S/C10H18O5S/c1-2-3-4-5-6-16-10(15,9(13)14)7-8(11)12/h15H,2-7H2,1H3,(H,11,12)(H,13,14)/p-2


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