2-(acetyloxymethyl)-3-methanoyl-5-methyl-2-oxidanyl-hexanoic acid

Systemtic Name: 2-(acetyloxymethyl)-3-methanoyl-5-methyl-2-oxidanyl-hexanoic acid Openeye Name: 2-(acetoxymethyl)-3-formyl-2-hydroxy-5-methyl-hexanoic acid CAS Name: 2-(acetyloxymethyl)-3-formyl-2-hydroxy-5-methylhexanoic acid IUPAC Name: 2-(acetyloxymethyl)-3-formyl-2-hydroxy-5-methylhexanoic acid Traditional Name: 2-(acetoxymethyl)-3-formyl-2-hydroxy-5-methyl-hexanoic acid Formula: C11H18O6 MolecularWeight: 246.25702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C=O)C(COC(=O)C)(C(=O)O)O

Isomeric SMILES

CC(C)CC(C=O)C(COC(=O)C)(C(=O)O)O

InChI

InChI=1S/C11H18O6/c1-7(2)4-9(5-12)11(16,10(14)15)6-17-8(3)13/h5,7,9,16H,4,6H2,1-3H3,(H,14,15)