N-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)acetamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(N-mesyl-2-methoxy-5-nitro-anilino)acetamide Formula: C17H15ClF3N3O6S MolecularWeight: 481.83071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)S(=O)(=O)C

InChI

InChI=1S/C17H15ClF3N3O6S/c1-30-15-6-4-11(24(26)27)8-14(15)23(31(2,28)29)9-16(25)22-10-3-5-13(18)12(7-10)17(19,20)21/h3-8H,9H2,1-2H3,(H,22,25)