2-azanylbutanedioic acid; 2-azanyl-4-methylsulfanyl-butanoic acid; hydrochloride

Systemtic Name: 2-azanylbutanedioic acid; 2-azanyl-4-methylsulfanyl-butanoic acid; hydrochloride Openeye Name: 2-aminobutanedioic acid; 2-amino-4-methylsulfanyl-butanoic acid; hydrochloride CAS Name: 2-aminobutanedioic acid; 2-amino-4-(methylthio)butanoic acid; hydrochloride IUPAC Name: 2-aminobutanedioic acid; 2-amino-4-methylsulfanylbutanoic acid; hydrochloride Traditional Name: 2-amino-4-(methylthio)butyric acid; 2-aminosuccinic acid; hydrochloride Formula: C9H19ClN2O6S MolecularWeight: 318.77496

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)N.C(C(C(=O)O)N)C(=O)O.Cl

Isomeric SMILES

CSCCC(C(=O)O)N.C(C(C(=O)O)N)C(=O)O.Cl

InChI

InChI=1S/C5H11NO2S.C4H7NO4.ClH/c1-9-3-2-4(6)5(7)8;5-2(4(8)9)1-3(6)7;/h4H,2-3,6H2,1H3,(H,7,8);2H,1,5H2,(H,6,7)(H,8,9);1H