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heptyl docosanoate

heptyl docosanoate

Systemtic Name:heptyl docosanoate
Openeye Name:heptyl docosanoate
CAS Name:docosanoic acid heptyl ester
IUPAC Name:heptyl docosanoate
Traditional Name:behenic acid heptyl ester
Formula: C29H58O2
MolecularWeight: 438.76962
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCC


InChI

InChI=1S/C29H58O2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-27-29(30)31-28-26-24-8-6-4-2/h3-28H2,1-2H3


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