ethyl 2-cyano-2-(2-methylpropyl)hexanoate

Systemtic Name: ethyl 2-cyano-2-(2-methylpropyl)hexanoate Openeye Name: ethyl 2-cyano-2-isobutyl-hexanoate CAS Name: 2-cyano-2-(2-methylpropyl)hexanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(2-methylpropyl)hexanoate Traditional Name: 2-cyano-2-isobutyl-hexanoic acid ethyl ester Formula: C13H23NO2 MolecularWeight: 225.32722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C)C)(C#N)C(=O)OCC

Isomeric SMILES

CCCCC(CC(C)C)(C#N)C(=O)OCC

InChI

InChI=1S/C13H23NO2/c1-5-7-8-13(10-14,9-11(3)4)12(15)16-6-2/h11H,5-9H2,1-4H3