2-methylpropanal; 1,3,4,5,6-pentakis(oxidanyl)hexan-2-one

Systemtic Name: 2-methylpropanal; 1,3,4,5,6-pentakis(oxidanyl)hexan-2-one Openeye Name: 2-methylpropanal; 1,3,4,5,6-pentahydroxyhexan-2-one CAS Name: 2-methylpropanal; 1,3,4,5,6-pentahydroxy-2-hexanone IUPAC Name: 2-methylpropanal; 1,3,4,5,6-pentahydroxyhexan-2-one Traditional Name: 2-methylpropionaldehyde; 1,3,4,5,6-pentahydroxyhexan-2-one Formula: C10H20O7 MolecularWeight: 252.2616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=O.C(C(C(C(C(=O)CO)O)O)O)O

Isomeric SMILES

CC(C)C=O.C(C(C(C(C(=O)CO)O)O)O)O

InChI

InChI=1S/C6H12O6.C4H8O/c7-1-3(9)5(11)6(12)4(10)2-8;1-4(2)3-5/h3,5-9,11-12H,1-2H2;3-4H,1-2H3