5-[5-chloranyl-2-cyano-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate

Systemtic Name: 5-[5-chloranyl-2-cyano-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate Openeye Name: 5-[5-chloro-2-cyano-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate CAS Name: 5-[5-chloro-2-cyano-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate IUPAC Name: 5-[5-chloro-2-cyano-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate Traditional Name: 5-[5-chloro-2-cyano-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate Formula: C15H5ClF3N2O5- MolecularWeight: 385.65881

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OC2=CC(=C(C=C2C#N)C(F)(F)F)Cl)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1OC2=CC(=C(C=C2C#N)C(F)(F)F)Cl)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H6ClF3N2O5/c16-11-5-13(7(6-20)3-10(11)15(17,18)19)26-8-1-2-12(21(24)25)9(4-8)14(22)23/h1-5H,(H,22,23)/p-1