N-[[2-fluoranyl-4-(trifluoromethyl)phenyl]methyl]-2-(3-oxidanylidene-1-phenethyl-piperazin-2-yl)ethanamide

Systemtic Name: N-[[2-fluoranyl-4-(trifluoromethyl)phenyl]methyl]-2-(3-oxidanylidene-1-phenethyl-piperazin-2-yl)ethanamide Openeye Name: N-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-(3-oxo-1-phenethyl-piperazin-2-yl)acetamide CAS Name: N-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-(3-oxo-1-phenethyl-2-piperazinyl)acetamide IUPAC Name: N-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-(3-oxo-1-phenethylpiperazin-2-yl)acetamide Traditional Name: N-[2-fluoro-4-(trifluoromethyl)benzyl]-2-(3-keto-1-phenethyl-piperazin-2-yl)acetamide Formula: C22H23F4N3O2 MolecularWeight: 437.430533

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)NCC2=C(C=C(C=C2)C(F)(F)F)F)CCC3=CC=CC=C3

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)NCC2=C(C=C(C=C2)C(F)(F)F)F)CCC3=CC=CC=C3

InChI

InChI=1S/C22H23F4N3O2/c23-18-12-17(22(24,25)26)7-6-16(18)14-28-20(30)13-19-21(31)27-9-11-29(19)10-8-15-4-2-1-3-5-15/h1-7,12,19H,8-11,13-14H2,(H,27,31)(H,28,30)