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

Systemtic Name: N-[3-cyano-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-4-nitro-benzamide Openeye Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-4-nitro-benzamide CAS Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-4-nitrobenzamide IUPAC Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-4-nitrobenzamide Traditional Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-4-nitro-benzamide Formula: C16H10F3N3O4 MolecularWeight: 365.26351

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10F3N3O4/c17-16(18,19)9-26-14-6-3-12(7-11(14)8-20)21-15(23)10-1-4-13(5-2-10)22(24)25/h1-7H,9H2,(H,21,23)