3-hexyl-4-oxidanylidene-cyclohexane-1-carboxylic acid

Systemtic Name: 3-hexyl-4-oxidanylidene-cyclohexane-1-carboxylic acid Openeye Name: 3-hexyl-4-oxo-cyclohexanecarboxylic acid CAS Name: 3-hexyl-4-oxo-1-cyclohexanecarboxylic acid IUPAC Name: 3-hexyl-4-oxocyclohexane-1-carboxylic acid Traditional Name: 3-hexyl-4-keto-cyclohexanecarboxylic acid Formula: C13H22O3 MolecularWeight: 226.31198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC(CCC1=O)C(=O)O

Isomeric SMILES

CCCCCCC1CC(CCC1=O)C(=O)O

InChI

InChI=1S/C13H22O3/c1-2-3-4-5-6-10-9-11(13(15)16)7-8-12(10)14/h10-11H,2-9H2,1H3,(H,15,16)