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cyanomethyl docosanoate

cyanomethyl docosanoate

Systemtic Name:cyanomethyl docosanoate
Openeye Name:cyanomethyl docosanoate
CAS Name:docosanoic acid cyanomethyl ester
IUPAC Name:cyanomethyl docosanoate
Traditional Name:behenic acid cyanomethyl ester
Formula: C24H45NO2
MolecularWeight: 379.6196
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC#N


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC#N


InChI

InChI=1S/C24H45NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)27-23-22-25/h2-21,23H2,1H3


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