pentadecyl (2S)-2-[[4-(trifluoromethyl)phenyl]carbonylamino]propanoate

Systemtic Name: pentadecyl (2S)-2-[[4-(trifluoromethyl)phenyl]carbonylamino]propanoate Openeye Name: pentadecyl (2S)-2-[[4-(trifluoromethyl)benzoyl]amino]propanoate CAS Name: (2S)-2-[[oxo-[4-(trifluoromethyl)phenyl]methyl]amino]propanoic acid pentadecyl ester IUPAC Name: pentadecyl (2S)-2-[[4-(trifluoromethyl)benzoyl]amino]propanoate Traditional Name: (2S)-2-[[4-(trifluoromethyl)benzoyl]amino]propionic acid pentadecyl ester Formula: C26H40F3NO3 MolecularWeight: 471.59591

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC(=O)C(C)NC(=O)C1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

CCCCCCCCCCCCCCCOC(=O)[C@H](C)NC(=O)C1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C26H40F3NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20-33-25(32)21(2)30-24(31)22-16-18-23(19-17-22)26(27,28)29/h16-19,21H,3-15,20H2,1-2H3,(H,30,31)/t21-/m0/s1