N-[3-cyano-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-[3-cyano-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-4-imidazol-1-yl-3-nitro-benzamide Formula: C19H12F3N5O4 MolecularWeight: 431.32489

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NC2=CC(=C(C=C2)OCC(F)(F)F)C#N)[N+](=O)[O-])N3C=CN=C3

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NC2=CC(=C(C=C2)OCC(F)(F)F)C#N)[N+](=O)[O-])N3C=CN=C3

InChI

InChI=1S/C19H12F3N5O4/c20-19(21,22)10-31-17-4-2-14(7-13(17)9-23)25-18(28)12-1-3-15(16(8-12)27(29)30)26-6-5-24-11-26/h1-8,11H,10H2,(H,25,28)