N-(2-piperidin-1-ium-1-ylethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: N-(2-piperidin-1-ium-1-ylethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide Openeye Name: N-(2-piperidin-1-ium-1-ylethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide CAS Name: N-[2-(1-piperidin-1-iumyl)ethyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide IUPAC Name: N-(2-piperidin-1-ium-1-ylethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide Traditional Name: N-(2-piperidin-1-ium-1-ylethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide Formula: C17H20F3N4O2+ MolecularWeight: 369.36151

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC(=O)C2=NC(=NO2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CC[NH+](CC1)CCNC(=O)C2=NC(=NO2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H19F3N4O2/c18-17(19,20)13-6-4-12(5-7-13)14-22-16(26-23-14)15(25)21-8-11-24-9-2-1-3-10-24/h4-7H,1-3,8-11H2,(H,21,25)/p+1