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octadecyl 2-(trifluoromethyl)benzoate

octadecyl 2-(trifluoromethyl)benzoate

Systemtic Name:octadecyl 2-(trifluoromethyl)benzoate
Openeye Name:octadecyl 2-(trifluoromethyl)benzoate
CAS Name:2-(trifluoromethyl)benzoic acid octadecyl ester
IUPAC Name:octadecyl 2-(trifluoromethyl)benzoate
Traditional Name:2-(trifluoromethyl)benzoic acid stearyl ester
Formula: C26H41F3O2
MolecularWeight: 442.59775
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(F)(F)F


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(F)(F)F


InChI

InChI=1S/C26H41F3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-31-25(30)23-20-17-18-21-24(23)26(27,28)29/h17-18,20-21H,2-16,19,22H2,1H3


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