4-methylpentyl 2-[[3-(trifluoromethyl)phenyl]carbonylamino]propanoate

Systemtic Name: 4-methylpentyl 2-[[3-(trifluoromethyl)phenyl]carbonylamino]propanoate Openeye Name: isohexyl 2-[[3-(trifluoromethyl)benzoyl]amino]propanoate CAS Name: 2-[[oxo-[3-(trifluoromethyl)phenyl]methyl]amino]propanoic acid 4-methylpentyl ester IUPAC Name: 4-methylpentyl 2-[[3-(trifluoromethyl)benzoyl]amino]propanoate Traditional Name: 2-[[3-(trifluoromethyl)benzoyl]amino]propionic acid isohexyl ester Formula: C17H22F3NO3 MolecularWeight: 345.35669

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22F3NO3/c1-11(2)6-5-9-24-16(23)12(3)21-15(22)13-7-4-8-14(10-13)17(18,19)20/h4,7-8,10-12H,5-6,9H2,1-3H3,(H,21,22)