N-(3-chlorophenyl)-5-piperidin-1-yl-3-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide

Systemtic Name: N-(3-chlorophenyl)-5-piperidin-1-yl-3-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide Openeye Name: N-(3-chlorophenyl)-5-(1-piperidyl)-3-[4-(trifluoromethyl)phenyl]isoxazole-4-carboxamide CAS Name: N-(3-chlorophenyl)-5-(1-piperidinyl)-3-[4-(trifluoromethyl)phenyl]-4-isoxazolecarboxamide IUPAC Name: N-(3-chlorophenyl)-5-piperidin-1-yl-3-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide Traditional Name: N-(3-chlorophenyl)-5-piperidino-3-[4-(trifluoromethyl)phenyl]isoxazole-4-carboxamide Formula: C22H19ClF3N3O2 MolecularWeight: 449.85337

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=NO2)C3=CC=C(C=C3)C(F)(F)F)C(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCN(CC1)C2=C(C(=NO2)C3=CC=C(C=C3)C(F)(F)F)C(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H19ClF3N3O2/c23-16-5-4-6-17(13-16)27-20(30)18-19(14-7-9-15(10-8-14)22(24,25)26)28-31-21(18)29-11-2-1-3-12-29/h4-10,13H,1-3,11-12H2,(H,27,30)