2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(4-methylpiperazin-4-ium-1-yl)ethanamide

Systemtic Name: 2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(4-methylpiperazin-4-ium-1-yl)ethanamide Openeye Name: 2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(4-methylpiperazin-4-ium-1-yl)acetamide CAS Name: 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-methyl-1-piperazin-4-iumyl)acetamide IUPAC Name: 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(4-methylpiperazin-4-ium-1-yl)acetamide Traditional Name: 2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(4-methylpiperazin-4-ium-1-yl)acetamide Formula: C13H17ClF3N4O+ MolecularWeight: 337.74849

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)CC2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)CC2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C13H16ClF3N4O/c1-20-2-4-21(5-3-20)19-12(22)7-11-10(14)6-9(8-18-11)13(15,16)17/h6,8H,2-5,7H2,1H3,(H,19,22)/p+1