N-(2-methylsulfanylphenyl)-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzamide

Systemtic Name: N-(2-methylsulfanylphenyl)-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzamide Openeye Name: N-(2-methylsulfanylphenyl)-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzamide CAS Name: N-[2-(methylthio)phenyl]-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzamide IUPAC Name: N-(2-methylsulfanylphenyl)-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzamide Traditional Name: N-[2-(methylthio)phenyl]-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzamide Formula: C21H15F3N2O4S MolecularWeight: 448.41501

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C2=CC=CC=C2OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C2=CC=CC=C2OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H15F3N2O4S/c1-31-19-9-5-3-7-15(19)25-20(27)14-6-2-4-8-17(14)30-18-11-10-13(21(22,23)24)12-16(18)26(28)29/h2-12H,1H3,(H,25,27)