1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-ium

Systemtic Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-ium Openeye Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-ium CAS Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-[5-(trifluoromethyl)-2-pyridin-1-iumyl]piperazin-1-ium IUPAC Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-ium Traditional Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-ium Formula: C17H24F3N5+2 MolecularWeight: 355.40117

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1)C)C[NH+]2CCN(CC2)C3=[NH+]C=C(C=C3)C(F)(F)F

Isomeric SMILES

CCC1=NC(=C(N1)C)C[NH+]2CCN(CC2)C3=[NH+]C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H22F3N5/c1-3-15-22-12(2)14(23-15)11-24-6-8-25(9-7-24)16-5-4-13(10-21-16)17(18,19)20/h4-5,10H,3,6-9,11H2,1-2H3,(H,22,23)/p+2