3-(1-hydroxyethyloxy)-2-sulfanyl-butanoate

Systemtic Name: 3-(1-hydroxyethyloxy)-2-sulfanyl-butanoate Openeye Name: 3-(1-hydroxyethoxy)-2-sulfanyl-butanoate CAS Name: 3-(1-hydroxyethoxy)-2-mercaptobutanoate IUPAC Name: 3-(1-hydroxyethoxy)-2-sulfanylbutanoate Traditional Name: 3-(1-hydroxyethoxy)-2-mercapto-butyrate Formula: C6H11O4S- MolecularWeight: 179.21414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)[O-])S)OC(C)O

Isomeric SMILES

CC(C(C(=O)[O-])S)OC(C)O

InChI

InChI=1S/C6H12O4S/c1-3(10-4(2)7)5(11)6(8)9/h3-5,7,11H,1-2H3,(H,8,9)/p-1