tert-butyl 3-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methoxycarbonylamino]propanoate

Systemtic Name: tert-butyl 3-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methoxycarbonylamino]propanoate Openeye Name: tert-butyl 3-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methoxycarbonylamino]propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[oxo-[[2-(trifluoromethyl)phenyl]methoxy]methyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)phenyl]methoxycarbonylamino]propanoate Traditional Name: 3-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)benzyl]oxycarbonylamino]propionic acid tert-butyl ester Formula: C24H25F3N2O4 MolecularWeight: 462.46151

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)OCC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)OCC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C24H25F3N2O4/c1-23(2,3)33-21(30)20(12-16-13-28-19-11-7-5-9-17(16)19)29-22(31)32-14-15-8-4-6-10-18(15)24(25,26)27/h4-11,13,20,28H,12,14H2,1-3H3,(H,29,31)