N-[5-[5-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyridin-2-yl]-4-nitro-benzamide

Systemtic Name: N-[5-[5-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyridin-2-yl]-4-nitro-benzamide Openeye Name: N-[5-[5-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]-2-pyridyl]-4-nitro-benzamide CAS Name: N-[5-[5-methoxy-2-(trifluoromethyl)-1-benzimidazolyl]-2-pyridinyl]-4-nitrobenzamide IUPAC Name: N-[5-[5-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]pyridin-2-yl]-4-nitrobenzamide Traditional Name: N-[5-[5-methoxy-2-(trifluoromethyl)benzimidazol-1-yl]-2-pyridyl]-4-nitro-benzamide Formula: C21H14F3N5O4 MolecularWeight: 457.36217

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=N2)C(F)(F)F)C3=CN=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=N2)C(F)(F)F)C3=CN=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H14F3N5O4/c1-33-15-7-8-17-16(10-15)26-20(21(22,23)24)28(17)14-6-9-18(25-11-14)27-19(30)12-2-4-13(5-3-12)29(31)32/h2-11H,1H3,(H,25,27,30)