2-(4-ethoxyphenyl)-2-propan-2-yloxy-3-[[4-(trifluoromethyloxy)phenyl]methoxycarbonylamino]propanoic acid

Systemtic Name: 2-(4-ethoxyphenyl)-2-propan-2-yloxy-3-[[4-(trifluoromethyloxy)phenyl]methoxycarbonylamino]propanoic acid Openeye Name: 2-(4-ethoxyphenyl)-2-isopropoxy-3-[[4-(trifluoromethoxy)phenyl]methoxycarbonylamino]propanoic acid CAS Name: 2-(4-ethoxyphenyl)-3-[[oxo-[[4-(trifluoromethoxy)phenyl]methoxy]methyl]amino]-2-propan-2-yloxypropanoic acid IUPAC Name: 2-(4-ethoxyphenyl)-2-propan-2-yloxy-3-[[4-(trifluoromethoxy)phenyl]methoxycarbonylamino]propanoic acid Traditional Name: 2-isopropoxy-2-p-phenetyl-3-[[4-(trifluoromethoxy)benzyl]oxycarbonylamino]propionic acid Formula: C23H26F3NO7 MolecularWeight: 485.45025

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CNC(=O)OCC2=CC=C(C=C2)OC(F)(F)F)(C(=O)O)OC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(CNC(=O)OCC2=CC=C(C=C2)OC(F)(F)F)(C(=O)O)OC(C)C

InChI

InChI=1S/C23H26F3NO7/c1-4-31-18-11-7-17(8-12-18)22(20(28)29,33-15(2)3)14-27-21(30)32-13-16-5-9-19(10-6-16)34-23(24,25)26/h5-12,15H,4,13-14H2,1-3H3,(H,27,30)(H,28,29)