2-[4-(furan-2-ylmethyl)piperazin-1-ium-1-yl]-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[4-(furan-2-ylmethyl)piperazin-1-ium-1-yl]-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[4-(2-furylmethyl)piperazin-1-ium-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[4-(2-furanylmethyl)-1-piperazin-1-iumyl]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[4-(furan-2-ylmethyl)piperazin-1-ium-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[4-(2-furfuryl)piperazin-1-ium-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C18H21F3N3O2+ MolecularWeight: 368.37345

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC(=C2)C(F)(F)F)CC3=CC=CO3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC(=C2)C(F)(F)F)CC3=CC=CO3

InChI

InChI=1S/C18H20F3N3O2/c19-18(20,21)14-3-1-4-15(11-14)22-17(25)13-24-8-6-23(7-9-24)12-16-5-2-10-26-16/h1-5,10-11H,6-9,12-13H2,(H,22,25)/p+1