2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-[2-morpholino-5-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]-N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-[2-morpholino-5-(trifluoromethyl)phenyl]acetamide Formula: C21H28F3N4O3+ MolecularWeight: 441.46723

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CC[NH+](CC2)CC(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCOCC4

Isomeric SMILES

C1CC1C(=O)N2CC[NH+](CC2)CC(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCOCC4

InChI

InChI=1S/C21H27F3N4O3/c22-21(23,24)16-3-4-18(27-9-11-31-12-10-27)17(13-16)25-19(29)14-26-5-7-28(8-6-26)20(30)15-1-2-15/h3-4,13,15H,1-2,5-12,14H2,(H,25,29)/p+1