2-azanyl-4-methylsulfanyl-2-sulfooxy-butanoic acid

Systemtic Name: 2-azanyl-4-methylsulfanyl-2-sulfooxy-butanoic acid Openeye Name: 2-amino-4-methylsulfanyl-2-sulfooxy-butanoic acid CAS Name: 2-amino-4-(methylthio)-2-sulfooxybutanoic acid IUPAC Name: 2-amino-4-methylsulfanyl-2-sulfooxybutanoic acid Traditional Name: 2-amino-4-(methylthio)-2-sulfoxy-butyric acid Formula: C5H11NO6S2 MolecularWeight: 245.27394

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)(N)OS(=O)(=O)O

Isomeric SMILES

CSCCC(C(=O)O)(N)OS(=O)(=O)O

InChI

InChI=1S/C5H11NO6S2/c1-13-3-2-5(6,4(7)8)12-14(9,10)11/h2-3,6H2,1H3,(H,7,8)(H,9,10,11)