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

Systemtic Name: 3-[2-(4-phenylpiperazin-1-ium-1-yl)ethanoylamino]-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-[[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 3-[[1-oxo-2-(4-phenyl-1-piperazin-1-iumyl)ethyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-[[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-[[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide Formula: C26H26F3N4O2+ MolecularWeight: 483.50545

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C26H25F3N4O2/c27-26(28,29)20-7-5-9-22(17-20)31-25(35)19-6-4-8-21(16-19)30-24(34)18-32-12-14-33(15-13-32)23-10-2-1-3-11-23/h1-11,16-17H,12-15,18H2,(H,30,34)(H,31,35)/p+1