N-[4-cyano-3-(trifluoromethyl)phenyl]-4-(4-hydroxyphenyl)-2-oxidanyl-2-piperidin-4-yl-but-3-ynamide

Systemtic Name: N-[4-cyano-3-(trifluoromethyl)phenyl]-4-(4-hydroxyphenyl)-2-oxidanyl-2-piperidin-4-yl-but-3-ynamide Openeye Name: N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-4-(4-hydroxyphenyl)-2-(4-piperidyl)but-3-ynamide CAS Name: N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-4-(4-hydroxyphenyl)-2-(4-piperidinyl)-3-butynamide IUPAC Name: N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-4-(4-hydroxyphenyl)-2-piperidin-4-ylbut-3-ynamide Traditional Name: N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-4-(4-hydroxyphenyl)-2-(4-piperidyl)but-3-ynamide Formula: C23H20F3N3O3 MolecularWeight: 443.41841

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(C#CC2=CC=C(C=C2)O)(C(=O)NC3=CC(=C(C=C3)C#N)C(F)(F)F)O

Isomeric SMILES

C1CNCCC1C(C#CC2=CC=C(C=C2)O)(C(=O)NC3=CC(=C(C=C3)C#N)C(F)(F)F)O

InChI

InChI=1S/C23H20F3N3O3/c24-23(25,26)20-13-18(4-3-16(20)14-27)29-21(31)22(32,17-8-11-28-12-9-17)10-7-15-1-5-19(30)6-2-15/h1-6,13,17,28,30,32H,8-9,11-12H2,(H,29,31)