2-azanyl-3-oxidanyl-butanoic acid; 2-azanylpropanoic acid; 2-[(2-azanyl-3-sulfanyl-propanoyl)oxyamino]propanoic acid

Systemtic Name: 2-azanyl-3-oxidanyl-butanoic acid; 2-azanylpropanoic acid; 2-[(2-azanyl-3-sulfanyl-propanoyl)oxyamino]propanoic acid Openeye Name: 2-amino-3-hydroxy-butanoic acid; 2-aminopropanoic acid; 2-[(2-amino-3-sulfanyl-propanoyl)oxyamino]propanoic acid CAS Name: 2-amino-3-hydroxybutanoic acid; 2-[(2-amino-3-mercapto-1-oxopropoxy)amino]propanoic acid; 2-aminopropanoic acid IUPAC Name: 2-amino-3-hydroxybutanoic acid; 2-aminopropanoic acid; 2-[(2-amino-3-sulfanylpropanoyl)oxyamino]propanoic acid Traditional Name: 2-amino-3-hydroxy-butyric acid; 2-[(2-amino-3-mercapto-propanoyl)oxyamino]propionic acid; 2-aminopropionic acid Formula: C13H28N4O9S MolecularWeight: 416.44782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)N)O.CC(C(=O)O)N.CC(C(=O)O)NOC(=O)C(CS)N

Isomeric SMILES

CC(C(C(=O)O)N)O.CC(C(=O)O)N.CC(C(=O)O)NOC(=O)C(CS)N

InChI

InChI=1S/C6H12N2O4S.C4H9NO3.C3H7NO2/c1-3(5(9)10)8-12-6(11)4(7)2-13;1-2(6)3(5)4(7)8;1-2(4)3(5)6/h3-4,8,13H,2,7H2,1H3,(H,9,10);2-3,6H,5H2,1H3,(H,7,8);2H,4H2,1H3,(H,5,6)