sodium; 2-azanyl-3-sulfanyl-propanoic acid; 2-(carboxymethyl)-2,4-bis(oxidanyl)-4-oxidanylidene-butanoate

Systemtic Name: sodium; 2-azanyl-3-sulfanyl-propanoic acid; 2-(carboxymethyl)-2,4-bis(oxidanyl)-4-oxidanylidene-butanoate Openeye Name: sodium; 2-amino-3-sulfanyl-propanoic acid; 2-(carboxymethyl)-2,4-dihydroxy-4-oxo-butanoate CAS Name: sodium; 2-amino-3-mercaptopropanoic acid; 2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate IUPAC Name: sodium; 2-amino-3-sulfanylpropanoic acid; 2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate Traditional Name: sodium; 2-amino-3-mercapto-propionic acid; 2-(carboxymethyl)-2,4-dihydroxy-4-keto-butyrate Formula: C9H14NNaO9S MolecularWeight: 335.26353

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C(C(=O)O)N)S.C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O.[Na+]

Isomeric SMILES

C(C(C(=O)O)N)S.C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O.[Na+]

InChI

InChI=1S/C6H8O7.C3H7NO2S.Na/c7-3(8)1-6(13,5(11)12)2-4(9)10;4-2(1-7)3(5)6;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);2,7H,1,4H2,(H,5,6);/q;;+1/p-1