3-[[2-fluoranyl-5-(trifluoromethyl)phenyl]methoxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: 3-[[2-fluoranyl-5-(trifluoromethyl)phenyl]methoxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-[[2-fluoro-5-(trifluoromethyl)phenyl]methoxy]propanoic acid CAS Name: 3-[[2-fluoro-5-(trifluoromethyl)phenyl]methoxy]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[2-fluoro-5-(trifluoromethyl)phenyl]methoxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-[2-fluoro-5-(trifluoromethyl)benzyl]oxy-propionic acid Formula: C16H19F4NO5 MolecularWeight: 381.319373

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(COCC1=C(C=CC(=C1)C(F)(F)F)F)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(COCC1=C(C=CC(=C1)C(F)(F)F)F)C(=O)O

InChI

InChI=1S/C16H19F4NO5/c1-15(2,3)26-14(24)21-12(13(22)23)8-25-7-9-6-10(16(18,19)20)4-5-11(9)17/h4-6,12H,7-8H2,1-3H3,(H,21,24)(H,22,23)