4-hexoxy-2,3-bis(oxidanyl)-4-oxidanylidene-butanoate

Systemtic Name: 4-hexoxy-2,3-bis(oxidanyl)-4-oxidanylidene-butanoate Openeye Name: 4-hexoxy-2,3-dihydroxy-4-oxo-butanoate CAS Name: 4-hexoxy-2,3-dihydroxy-4-oxobutanoate IUPAC Name: 4-hexoxy-2,3-dihydroxy-4-oxobutanoate Traditional Name: 4-hexoxy-2,3-dihydroxy-4-keto-butyrate Formula: C10H17O6- MolecularWeight: 233.23838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(C(C(=O)[O-])O)O

Isomeric SMILES

CCCCCCOC(=O)C(C(C(=O)[O-])O)O

InChI

InChI=1S/C10H18O6/c1-2-3-4-5-6-16-10(15)8(12)7(11)9(13)14/h7-8,11-12H,2-6H2,1H3,(H,13,14)/p-1