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

Systemtic Name: 2-[4-(4-oxidanylidenepentanoyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[4-(4-oxopentanoyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[4-(1,4-dioxopentyl)-1-piperazin-1-iumyl]-N-[2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[4-(4-oxopentanoyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[4-(4-ketopentanoyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide Formula: C18H23F3N3O3+ MolecularWeight: 386.38873

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22F3N3O3/c1-13(25)6-7-17(27)24-10-8-23(9-11-24)12-16(26)22-15-5-3-2-4-14(15)18(19,20)21/h2-5H,6-12H2,1H3,(H,22,26)/p+1