3-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]-N-[3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 3-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 3-[[2-(4-acetyl-1-piperazin-1-iumyl)-1-oxoethyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide Formula: C22H24F3N4O3+ MolecularWeight: 449.44617

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H23F3N4O3/c1-15(30)29-10-8-28(9-11-29)14-20(31)26-18-6-2-4-16(12-18)21(32)27-19-7-3-5-17(13-19)22(23,24)25/h2-7,12-13H,8-11,14H2,1H3,(H,26,31)(H,27,32)/p+1