hexadecyl 2-[[2-(trifluoromethyl)phenyl]carbonylamino]ethanoate

Systemtic Name: hexadecyl 2-[[2-(trifluoromethyl)phenyl]carbonylamino]ethanoate Openeye Name: hexadecyl 2-[[2-(trifluoromethyl)benzoyl]amino]acetate CAS Name: 2-[[oxo-[2-(trifluoromethyl)phenyl]methyl]amino]acetic acid hexadecyl ester IUPAC Name: hexadecyl 2-[[2-(trifluoromethyl)benzoyl]amino]acetate Traditional Name: 2-[[2-(trifluoromethyl)benzoyl]amino]acetic acid cetyl ester Formula: C26H40F3NO3 MolecularWeight: 471.59591

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)CNC(=O)C1=CC=CC=C1C(F)(F)F

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)CNC(=O)C1=CC=CC=C1C(F)(F)F

InChI

InChI=1S/C26H40F3NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-33-24(31)21-30-25(32)22-18-15-16-19-23(22)26(27,28)29/h15-16,18-19H,2-14,17,20-21H2,1H3,(H,30,32)