3,5,5-trimethylhexanoate

Systemtic Name: 3,5,5-trimethylhexanoate Openeye Name: 3,5,5-trimethylhexanoate CAS Name: 3,5,5-trimethylhexanoate IUPAC Name: 3,5,5-trimethylhexanoate Traditional Name: 3,5,5-trimethylhexanoate Formula: C9H17O2- MolecularWeight: 157.23008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H18O2/c1-7(5-8(10)11)6-9(2,3)4/h7H,5-6H2,1-4H3,(H,10,11)/p-1