1-(tert-butylamino)-3-[2-(2-phenylethynyl)-5-(trifluoromethyl)phenoxy]propan-2-ol

Systemtic Name: 1-(tert-butylamino)-3-[2-(2-phenylethynyl)-5-(trifluoromethyl)phenoxy]propan-2-ol Openeye Name: 1-(tert-butylamino)-3-[2-(2-phenylethynyl)-5-(trifluoromethyl)phenoxy]propan-2-ol CAS Name: 1-(tert-butylamino)-3-[2-(2-phenylethynyl)-5-(trifluoromethyl)phenoxy]-2-propanol IUPAC Name: 1-(tert-butylamino)-3-[2-(2-phenylethynyl)-5-(trifluoromethyl)phenoxy]propan-2-ol Traditional Name: 1-(tert-butylamino)-3-[2-(2-phenylethynyl)-5-(trifluoromethyl)phenoxy]propan-2-ol Formula: C22H24F3NO2 MolecularWeight: 391.42667

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=C(C=CC(=C1)C(F)(F)F)C#CC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)NCC(COC1=C(C=CC(=C1)C(F)(F)F)C#CC2=CC=CC=C2)O

InChI

InChI=1S/C22H24F3NO2/c1-21(2,3)26-14-19(27)15-28-20-13-18(22(23,24)25)12-11-17(20)10-9-16-7-5-4-6-8-16/h4-8,11-13,19,26-27H,14-15H2,1-3H3