2-(4-butanoylpiperazin-1-ium-1-yl)-N-[2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(4-butanoylpiperazin-1-ium-1-yl)-N-[2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(4-butanoylpiperazin-1-ium-1-yl)-N-[2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[4-(1-oxobutyl)-1-piperazin-1-iumyl]-N-[2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(4-butanoylpiperazin-1-ium-1-yl)-N-[2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-(4-butyrylpiperazin-1-ium-1-yl)-N-[2-(trifluoromethyl)phenyl]acetamide Formula: C17H23F3N3O2+ MolecularWeight: 358.37863

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CCCC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C17H22F3N3O2/c1-2-5-16(25)23-10-8-22(9-11-23)12-15(24)21-14-7-4-3-6-13(14)17(18,19)20/h3-4,6-7H,2,5,8-12H2,1H3,(H,21,24)/p+1