1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanone

Systemtic Name: 1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanone Openeye Name: 1-[4-(6-nitro-3-pyridyl)piperazin-1-yl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanone CAS Name: 1-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-2-[2-(trifluoromethyl)-1-benzimidazolyl]ethanone IUPAC Name: 1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanone Traditional Name: 1-[4-(6-nitro-3-pyridyl)piperazino]-2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanone Formula: C19H17F3N6O3 MolecularWeight: 434.37189

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17F3N6O3/c20-19(21,22)18-24-14-3-1-2-4-15(14)27(18)12-17(29)26-9-7-25(8-10-26)13-5-6-16(23-11-13)28(30)31/h1-6,11H,7-10,12H2