1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanone

Systemtic Name: 1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanone Openeye Name: 1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanone CAS Name: 1-[4-(4-pyridin-1-iumyl)-1-piperazinyl]-2-[2-(trifluoromethyl)-1-benzimidazolyl]ethanone IUPAC Name: 1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanone Traditional Name: 1-(4-pyridin-1-ium-4-ylpiperazino)-2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanone Formula: C19H19F3N5O+ MolecularWeight: 390.38227

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=[NH+]C=C2)C(=O)CN3C4=CC=CC=C4N=C3C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=[NH+]C=C2)C(=O)CN3C4=CC=CC=C4N=C3C(F)(F)F

InChI

InChI=1S/C19H18F3N5O/c20-19(21,22)18-24-15-3-1-2-4-16(15)27(18)13-17(28)26-11-9-25(10-12-26)14-5-7-23-8-6-14/h1-8H,9-13H2/p+1