2-[4-(1H-indazol-3-ylcarbonyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[4-(1H-indazol-3-ylcarbonyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[4-(1H-indazole-3-carbonyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[4-[1H-indazol-3-yl(oxo)methyl]-1-piperazin-1-iumyl]-N-[2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[4-(1H-indazole-3-carbonyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[4-(1H-indazole-3-carbonyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide Formula: C21H21F3N5O2+ MolecularWeight: 432.41895

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2C(F)(F)F)C(=O)C3=NNC4=CC=CC=C43

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2C(F)(F)F)C(=O)C3=NNC4=CC=CC=C43

InChI

InChI=1S/C21H20F3N5O2/c22-21(23,24)15-6-2-4-8-17(15)25-18(30)13-28-9-11-29(12-10-28)20(31)19-14-5-1-3-7-16(14)26-27-19/h1-8H,9-13H2,(H,25,30)(H,26,27)/p+1