4-[2-oxidanylidene-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperazin-4-ium-2-one

Systemtic Name: 4-[2-oxidanylidene-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperazin-4-ium-2-one Openeye Name: 4-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperazin-4-ium-2-one CAS Name: 4-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]-2-piperazin-4-iumone IUPAC Name: 4-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperazin-4-ium-2-one Traditional Name: 4-[2-keto-2-[4-[3-(trifluoromethyl)phenyl]piperazino]ethyl]piperazin-4-ium-2-one Formula: C17H22F3N4O2+ MolecularWeight: 371.37739

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(=O)N1)CC(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1C[NH+](CC(=O)N1)CC(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C17H21F3N4O2/c18-17(19,20)13-2-1-3-14(10-13)23-6-8-24(9-7-23)16(26)12-22-5-4-21-15(25)11-22/h1-3,10H,4-9,11-12H2,(H,21,25)/p+1