N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[2-morpholino-5-(trifluoromethyl)phenyl]-2-(3-oxopiperazin-1-ium-1-yl)acetamide CAS Name: N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-2-(3-oxo-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-(3-oxopiperazin-1-ium-1-yl)acetamide Traditional Name: 2-(3-ketopiperazin-1-ium-1-yl)-N-[2-morpholino-5-(trifluoromethyl)phenyl]acetamide Formula: C17H22F3N4O3+ MolecularWeight: 387.37679

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(=O)N1)CC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

Isomeric SMILES

C1C[NH+](CC(=O)N1)CC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

InChI

InChI=1S/C17H21F3N4O3/c18-17(19,20)12-1-2-14(24-5-7-27-8-6-24)13(9-12)22-16(26)11-23-4-3-21-15(25)10-23/h1-2,9H,3-8,10-11H2,(H,21,25)(H,22,26)/p+1