N-[2-chloranyl-5-(trifluoromethylsulfonyl)phenyl]-2-(4-methylsulfinyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethylsulfonyl)phenyl]-2-(4-methylsulfinyl-2-nitro-phenoxy)ethanamide Openeye Name: N-[2-chloro-5-(trifluoromethylsulfonyl)phenyl]-2-(4-methylsulfinyl-2-nitro-phenoxy)acetamide CAS Name: N-[2-chloro-5-(trifluoromethylsulfonyl)phenyl]-2-(4-methylsulfinyl-2-nitrophenoxy)acetamide IUPAC Name: N-[2-chloro-5-(trifluoromethylsulfonyl)phenyl]-2-(4-methylsulfinyl-2-nitrophenoxy)acetamide Traditional Name: N-(2-chloro-5-triflyl-phenyl)-2-(4-methylsulfinyl-2-nitro-phenoxy)acetamide Formula: C16H12ClF3N2O7S2 MolecularWeight: 500.85389

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC(=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CS(=O)C1=CC(=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClF3N2O7S2/c1-30(26)9-2-5-14(13(6-9)22(24)25)29-8-15(23)21-12-7-10(3-4-11(12)17)31(27,28)16(18,19)20/h2-7H,8H2,1H3,(H,21,23)