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docosyl 7-methyloctanoate

docosyl 7-methyloctanoate

Systemtic Name:docosyl 7-methyloctanoate
Openeye Name:docosyl 7-methyloctanoate
CAS Name:7-methyloctanoic acid docosyl ester
IUPAC Name:docosyl 7-methyloctanoate
Traditional Name:7-methylcaprylic acid behenyl ester
Formula: C31H62O2
MolecularWeight: 466.82278
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCC(C)C


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCC(C)C


InChI

InChI=1S/C31H62O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26-29-33-31(32)28-25-23-24-27-30(2)3/h30H,4-29H2,1-3H3


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