hexyl 2-cyanoethanoate

Systemtic Name: hexyl 2-cyanoethanoate Openeye Name: hexyl 2-cyanoacetate CAS Name: 2-cyanoacetic acid hexyl ester IUPAC Name: hexyl 2-cyanoacetate Traditional Name: 2-cyanoacetic acid hexyl ester Formula: C9H15NO2 MolecularWeight: 169.2209

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC#N

Isomeric SMILES

CCCCCCOC(=O)CC#N

InChI

InChI=1S/C9H15NO2/c1-2-3-4-5-8-12-9(11)6-7-10/h2-6,8H2,1H3