octadecyl 2-cyanoethanoate

Systemtic Name: octadecyl 2-cyanoethanoate Openeye Name: octadecyl 2-cyanoacetate CAS Name: 2-cyanoacetic acid octadecyl ester IUPAC Name: octadecyl 2-cyanoacetate Traditional Name: 2-cyanoacetic acid stearyl ester Formula: C21H39NO2 MolecularWeight: 337.53986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)CC#N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CC#N

InChI

InChI=1S/C21H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-24-21(23)18-19-22/h2-18,20H2,1H3