3-(2-methylpropanoyl)cyclohexane-1-carboxylic acid

Systemtic Name: 3-(2-methylpropanoyl)cyclohexane-1-carboxylic acid Openeye Name: 3-(2-methylpropanoyl)cyclohexanecarboxylic acid CAS Name: 3-(2-methyl-1-oxopropyl)-1-cyclohexanecarboxylic acid IUPAC Name: 3-(2-methylpropanoyl)cyclohexane-1-carboxylic acid Traditional Name: 3-isobutyrylcyclohexanecarboxylic acid Formula: C11H18O3 MolecularWeight: 198.25882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1CCCC(C1)C(=O)O

Isomeric SMILES

CC(C)C(=O)C1CCCC(C1)C(=O)O

InChI

InChI=1S/C11H18O3/c1-7(2)10(12)8-4-3-5-9(6-8)11(13)14/h7-9H,3-6H2,1-2H3,(H,13,14)