5-ethoxy-3,3-dimethyl-5-oxidanylidene-pentanoate

Systemtic Name: 5-ethoxy-3,3-dimethyl-5-oxidanylidene-pentanoate Openeye Name: 5-ethoxy-3,3-dimethyl-5-oxo-pentanoate CAS Name: 5-ethoxy-3,3-dimethyl-5-oxopentanoate IUPAC Name: 5-ethoxy-3,3-dimethyl-5-oxopentanoate Traditional Name: 5-ethoxy-5-keto-3,3-dimethyl-valerate Formula: C9H15O4- MolecularWeight: 187.213

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16O4/c1-4-13-8(12)6-9(2,3)5-7(10)11/h4-6H2,1-3H3,(H,10,11)/p-1