3-[[2-fluoranyl-4-(trifluoromethyl)phenyl]methoxycarbonylamino]-2-methyl-2-phenyl-propanoic acid

Systemtic Name: 3-[[2-fluoranyl-4-(trifluoromethyl)phenyl]methoxycarbonylamino]-2-methyl-2-phenyl-propanoic acid Openeye Name: 3-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxycarbonylamino]-2-methyl-2-phenyl-propanoic acid CAS Name: 3-[[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy-oxomethyl]amino]-2-methyl-2-phenylpropanoic acid IUPAC Name: 3-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxycarbonylamino]-2-methyl-2-phenylpropanoic acid Traditional Name: 3-[[2-fluoro-4-(trifluoromethyl)benzyl]oxycarbonylamino]-2-methyl-2-phenyl-propionic acid Formula: C19H17F4NO4 MolecularWeight: 399.336193

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)OCC1=C(C=C(C=C1)C(F)(F)F)F)(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(CNC(=O)OCC1=C(C=C(C=C1)C(F)(F)F)F)(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H17F4NO4/c1-18(16(25)26,13-5-3-2-4-6-13)11-24-17(27)28-10-12-7-8-14(9-15(12)20)19(21,22)23/h2-9H,10-11H2,1H3,(H,24,27)(H,25,26)