2-(4-pyrazin-2-ylcarbonylpiperazin-1-ium-1-yl)-N-[2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(4-pyrazin-2-ylcarbonylpiperazin-1-ium-1-yl)-N-[2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[4-(pyrazine-2-carbonyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[4-[oxo(2-pyrazinyl)methyl]-1-piperazin-1-iumyl]-N-[2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[4-(pyrazine-2-carbonyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-(4-pyrazinoylpiperazin-1-ium-1-yl)-N-[2-(trifluoromethyl)phenyl]acetamide Formula: C18H19F3N5O2+ MolecularWeight: 394.37097

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2C(F)(F)F)C(=O)C3=NC=CN=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2C(F)(F)F)C(=O)C3=NC=CN=C3

InChI

InChI=1S/C18H18F3N5O2/c19-18(20,21)13-3-1-2-4-14(13)24-16(27)12-25-7-9-26(10-8-25)17(28)15-11-22-5-6-23-15/h1-6,11H,7-10,12H2,(H,24,27)/p+1