(1R)-2-[6-bromanyl-2-propan-2-yloxy-4-(trifluoromethyl)quinolin-5-yl]oxy-1-phenyl-ethanamine

Systemtic Name: (1R)-2-[6-bromanyl-2-propan-2-yloxy-4-(trifluoromethyl)quinolin-5-yl]oxy-1-phenyl-ethanamine Openeye Name: (1R)-2-[[6-bromo-2-isopropoxy-4-(trifluoromethyl)-5-quinolyl]oxy]-1-phenyl-ethanamine CAS Name: (1R)-2-[[6-bromo-2-propan-2-yloxy-4-(trifluoromethyl)-5-quinolinyl]oxy]-1-phenylethanamine IUPAC Name: (1R)-2-[6-bromo-2-propan-2-yloxy-4-(trifluoromethyl)quinolin-5-yl]oxy-1-phenylethanamine Traditional Name: [(1R)-2-[[6-bromo-2-isopropoxy-4-(trifluoromethyl)-5-quinolyl]oxy]-1-phenyl-ethyl]amine Formula: C21H20BrF3N2O2 MolecularWeight: 469.29491

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC2=C(C(=C1)C(F)(F)F)C(=C(C=C2)Br)OCC(C3=CC=CC=C3)N

Isomeric SMILES

CC(C)OC1=NC2=C(C(=C1)C(F)(F)F)C(=C(C=C2)Br)OC[C@@H](C3=CC=CC=C3)N

InChI

InChI=1S/C21H20BrF3N2O2/c1-12(2)29-18-10-14(21(23,24)25)19-17(27-18)9-8-15(22)20(19)28-11-16(26)13-6-4-3-5-7-13/h3-10,12,16H,11,26H2,1-2H3/t16-/m0/s1