6,6-dimethoxy-3-(2-methyl-1-oxidanylidene-propan-2-yl)-5-oxidanyl-hexanoate

Systemtic Name: 6,6-dimethoxy-3-(2-methyl-1-oxidanylidene-propan-2-yl)-5-oxidanyl-hexanoate Openeye Name: 3-(1,1-dimethyl-2-oxo-ethyl)-5-hydroxy-6,6-dimethoxy-hexanoate CAS Name: 5-hydroxy-6,6-dimethoxy-3-(2-methyl-1-oxopropan-2-yl)hexanoate IUPAC Name: 5-hydroxy-6,6-dimethoxy-3-(2-methyl-1-oxopropan-2-yl)hexanoate Traditional Name: 5-hydroxy-3-(2-keto-1,1-dimethyl-ethyl)-6,6-dimethoxy-hexanoate Formula: C12H21O6- MolecularWeight: 261.29154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=O)C(CC(C(OC)OC)O)CC(=O)[O-]

Isomeric SMILES

CC(C)(C=O)C(CC(C(OC)OC)O)CC(=O)[O-]

InChI

InChI=1S/C12H22O6/c1-12(2,7-13)8(6-10(15)16)5-9(14)11(17-3)18-4/h7-9,11,14H,5-6H2,1-4H3,(H,15,16)/p-1