6-(2-acetamidoethanoylamino)-2-[[4-(trifluoromethyl)phenyl]methoxycarbonylamino]hexanoic acid

Systemtic Name: 6-(2-acetamidoethanoylamino)-2-[[4-(trifluoromethyl)phenyl]methoxycarbonylamino]hexanoic acid Openeye Name: 6-[(2-acetamidoacetyl)amino]-2-[[4-(trifluoromethyl)phenyl]methoxycarbonylamino]hexanoic acid CAS Name: 6-[(2-acetamido-1-oxoethyl)amino]-2-[[oxo-[[4-(trifluoromethyl)phenyl]methoxy]methyl]amino]hexanoic acid IUPAC Name: 6-[(2-acetamidoacetyl)amino]-2-[[4-(trifluoromethyl)phenyl]methoxycarbonylamino]hexanoic acid Traditional Name: 6-[(2-acetamidoacetyl)amino]-2-[[4-(trifluoromethyl)benzyl]oxycarbonylamino]hexanoic acid Formula: C19H24F3N3O6 MolecularWeight: 447.40557

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC(=O)NCCCCC(C(=O)O)NC(=O)OCC1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

CC(=O)NCC(=O)NCCCCC(C(=O)O)NC(=O)OCC1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C19H24F3N3O6/c1-12(26)24-10-16(27)23-9-3-2-4-15(17(28)29)25-18(30)31-11-13-5-7-14(8-6-13)19(20,21)22/h5-8,15H,2-4,9-11H2,1H3,(H,23,27)(H,24,26)(H,25,30)(H,28,29)