N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-2-[4-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-2-[4-(trifluoromethyl)phenyl]ethanamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-2-[4-(trifluoromethyl)phenyl]acetamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylphenyl]-2-[4-(trifluoromethyl)phenyl]acetamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylphenyl]-2-[4-(trifluoromethyl)phenyl]acetamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-2-[4-(trifluoromethyl)phenyl]acetamide Formula: C22H27F3N3O+ MolecularWeight: 406.46449

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)CC3=CC=C(C=C3)C(F)(F)F)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)CC3=CC=C(C=C3)C(F)(F)F)C

InChI

InChI=1S/C22H26F3N3O/c1-3-27-10-12-28(13-11-27)20-9-8-19(14-16(20)2)26-21(29)15-17-4-6-18(7-5-17)22(23,24)25/h4-9,14H,3,10-13,15H2,1-2H3,(H,26,29)/p+1