N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]-4-(trifluoromethyl)benzamide Openeye Name: N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]-4-(trifluoromethyl)benzamide CAS Name: N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridin-1-iumyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]-4-(trifluoromethyl)benzamide Traditional Name: N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]-4-(trifluoromethyl)benzamide Formula: C18H21F3N4O+2 MolecularWeight: 366.38075

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=[NH+]C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=[NH+]C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H19F3N4O/c1-24-8-10-25(11-9-24)16-7-6-15(12-22-16)23-17(26)13-2-4-14(5-3-13)18(19,20)21/h2-7,12H,8-11H2,1H3,(H,23,26)/p+2