2-azanylbutanedioate; 2,3,4,5,6-pentakis(oxidanyl)hexanoate

Systemtic Name: 2-azanylbutanedioate; 2,3,4,5,6-pentakis(oxidanyl)hexanoate Openeye Name: 2-aminobutanedioate; 2,3,4,5,6-pentahydroxyhexanoate CAS Name: 2-aminobutanedioate; 2,3,4,5,6-pentahydroxyhexanoate IUPAC Name: 2-aminobutanedioate; 2,3,4,5,6-pentahydroxyhexanoate Traditional Name: 2-aminosuccinate; 2,3,4,5,6-pentahydroxyhexanoate Formula: C10H16NO11-3 MolecularWeight: 326.23414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C(C(=O)[O-])N)C(=O)[O-].C(C(C(C(C(C(=O)[O-])O)O)O)O)O

Isomeric SMILES

C(C(C(=O)[O-])N)C(=O)[O-].C(C(C(C(C(C(=O)[O-])O)O)O)O)O

InChI

InChI=1S/C6H12O7.C4H7NO4/c7-1-2(8)3(9)4(10)5(11)6(12)13;5-2(4(8)9)1-3(6)7/h2-5,7-11H,1H2,(H,12,13);2H,1,5H2,(H,6,7)(H,8,9)/p-3