sodium [3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl] 2-oxidanylidenepropanoate

Systemtic Name: sodium [3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl] 2-oxidanylidenepropanoate Openeye Name: sodium (1-formyl-2,3,4,5-tetrahydroxy-pentyl) 2-oxopropanoate CAS Name: sodium 2-oxopropanoic acid (3,4,5,6-tetrahydroxy-1-oxohexan-2-yl) ester IUPAC Name: sodium (3,4,5,6-tetrahydroxy-1-oxohexan-2-yl) 2-oxopropanoate Traditional Name: sodium 2-ketopropionic acid (1-formyl-2,3,4,5-tetrahydroxy-pentyl) ester Formula: C9H14NaO8+ MolecularWeight: 273.19243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=O)OC(C=O)C(C(C(CO)O)O)O.[Na+]

Isomeric SMILES

CC(=O)C(=O)OC(C=O)C(C(C(CO)O)O)O.[Na+]

InChI

InChI=1S/C9H14O8.Na/c1-4(12)9(16)17-6(3-11)8(15)7(14)5(13)2-10;/h3,5-8,10,13-15H,2H2,1H3;/q;+1