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

Systemtic Name: N-cyclopropyl-2-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-cyclopropyl-2-[[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-cyclopropyl-2-[[1-oxo-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazin-1-iumyl]ethyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-[[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-cyclopropyl-2-[[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C23H26F3N4O2+ MolecularWeight: 447.47335

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CC1NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C23H25F3N4O2/c24-23(25,26)16-4-3-5-18(14-16)30-12-10-29(11-13-30)15-21(31)28-20-7-2-1-6-19(20)22(32)27-17-8-9-17/h1-7,14,17H,8-13,15H2,(H,27,32)(H,28,31)/p+1