2-(2,3-dimethylpentan-2-yl)octanoic acid

Systemtic Name: 2-(2,3-dimethylpentan-2-yl)octanoic acid Openeye Name: 2-(1,1,2-trimethylbutyl)octanoic acid CAS Name: 2-(2,3-dimethylpentan-2-yl)octanoic acid IUPAC Name: 2-(2,3-dimethylpentan-2-yl)octanoic acid Traditional Name: 2-(1,1,2-trimethylbutyl)caprylic acid Formula: C15H30O2 MolecularWeight: 242.3975

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)C(C)(C)C(C)CC

Isomeric SMILES

CCCCCCC(C(=O)O)C(C)(C)C(C)CC

InChI

InChI=1S/C15H30O2/c1-6-8-9-10-11-13(14(16)17)15(4,5)12(3)7-2/h12-13H,6-11H2,1-5H3,(H,16,17)