2-(3-ethoxy-4-nitro-phenoxy)-5-[2,2,2-tris(fluoranyl)ethanoyl]benzenecarbonitrile

Systemtic Name: 2-(3-ethoxy-4-nitro-phenoxy)-5-[2,2,2-tris(fluoranyl)ethanoyl]benzenecarbonitrile Openeye Name: 2-(3-ethoxy-4-nitro-phenoxy)-5-(2,2,2-trifluoroacetyl)benzonitrile CAS Name: 2-(3-ethoxy-4-nitrophenoxy)-5-(2,2,2-trifluoro-1-oxoethyl)benzonitrile IUPAC Name: 2-(3-ethoxy-4-nitrophenoxy)-5-(2,2,2-trifluoroacetyl)benzonitrile Traditional Name: 2-(3-ethoxy-4-nitro-phenoxy)-5-(2,2,2-trifluoroacetyl)benzonitrile Formula: C17H11F3N2O5 MolecularWeight: 380.27485

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(=O)C(F)(F)F)C#N)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(=O)C(F)(F)F)C#N)[N+](=O)[O-]

InChI

InChI=1S/C17H11F3N2O5/c1-2-26-15-8-12(4-5-13(15)22(24)25)27-14-6-3-10(7-11(14)9-21)16(23)17(18,19)20/h3-8H,2H2,1H3