5-(pyrrolidin-1-ium-1-ylmethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole

Systemtic Name: 5-(pyrrolidin-1-ium-1-ylmethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole Openeye Name: 5-(pyrrolidin-1-ium-1-ylmethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole CAS Name: 5-(1-pyrrolidin-1-iumylmethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole IUPAC Name: 5-(pyrrolidin-1-ium-1-ylmethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole Traditional Name: 5-(pyrrolidin-1-ium-1-ylmethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole Formula: C14H15F3N3O+ MolecularWeight: 298.28361

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=NC(=NO2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CC[NH+](C1)CC2=NC(=NO2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C14H14F3N3O/c15-14(16,17)11-5-3-10(4-6-11)13-18-12(21-19-13)9-20-7-1-2-8-20/h3-6H,1-2,7-9H2/p+1