4-ethyl-4-methyl-3-oxidanylidene-hexanoic acid

Systemtic Name: 4-ethyl-4-methyl-3-oxidanylidene-hexanoic acid Openeye Name: 4-ethyl-4-methyl-3-oxo-hexanoic acid CAS Name: 4-ethyl-4-methyl-3-oxohexanoic acid IUPAC Name: 4-ethyl-4-methyl-3-oxohexanoic acid Traditional Name: 4-ethyl-3-keto-4-methyl-hexanoic acid Formula: C9H16O3 MolecularWeight: 172.22154

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC)C(=O)CC(=O)O

Isomeric SMILES

CCC(C)(CC)C(=O)CC(=O)O

InChI

InChI=1S/C9H16O3/c1-4-9(3,5-2)7(10)6-8(11)12/h4-6H2,1-3H3,(H,11,12)