cyanomethyl heptacosanoate

Systemtic Name: cyanomethyl heptacosanoate Openeye Name: cyanomethyl heptacosanoate CAS Name: heptacosanoic acid cyanomethyl ester IUPAC Name: cyanomethyl heptacosanoate Traditional Name: heptacosanoic acid cyanomethyl ester Formula: C29H55NO2 MolecularWeight: 449.7525

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC#N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC#N

InChI

InChI=1S/C29H55NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-29(31)32-28-27-30/h2-26,28H2,1H3