N-[2-(4-chloranyl-3,5-dimethyl-phenoxy)-5-(trifluoromethyl)phenyl]-4-nitro-benzamide

Systemtic Name: N-[2-(4-chloranyl-3,5-dimethyl-phenoxy)-5-(trifluoromethyl)phenyl]-4-nitro-benzamide Openeye Name: N-[2-(4-chloro-3,5-dimethyl-phenoxy)-5-(trifluoromethyl)phenyl]-4-nitro-benzamide CAS Name: N-[2-(4-chloro-3,5-dimethylphenoxy)-5-(trifluoromethyl)phenyl]-4-nitrobenzamide IUPAC Name: N-[2-(4-chloro-3,5-dimethylphenoxy)-5-(trifluoromethyl)phenyl]-4-nitrobenzamide Traditional Name: N-[2-(4-chloro-3,5-dimethyl-phenoxy)-5-(trifluoromethyl)phenyl]-4-nitro-benzamide Formula: C22H16ClF3N2O4 MolecularWeight: 464.82165

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H16ClF3N2O4/c1-12-9-17(10-13(2)20(12)23)32-19-8-5-15(22(24,25)26)11-18(19)27-21(29)14-3-6-16(7-4-14)28(30)31/h3-11H,1-2H3,(H,27,29)