2-[[2-chloranyl-5-(trifluoromethyl)phenyl]-methylsulfonyl-amino]-N-(2-methyl-5-nitro-phenyl)ethanamide

Systemtic Name: 2-[[2-chloranyl-5-(trifluoromethyl)phenyl]-methylsulfonyl-amino]-N-(2-methyl-5-nitro-phenyl)ethanamide Openeye Name: 2-[2-chloro-N-methylsulfonyl-5-(trifluoromethyl)anilino]-N-(2-methyl-5-nitro-phenyl)acetamide CAS Name: 2-[2-chloro-N-methylsulfonyl-5-(trifluoromethyl)anilino]-N-(2-methyl-5-nitrophenyl)acetamide IUPAC Name: 2-[2-chloro-N-methylsulfonyl-5-(trifluoromethyl)anilino]-N-(2-methyl-5-nitrophenyl)acetamide Traditional Name: 2-[2-chloro-N-mesyl-5-(trifluoromethyl)anilino]-N-(2-methyl-5-nitro-phenyl)acetamide Formula: C17H15ClF3N3O5S MolecularWeight: 465.83131

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CN(C2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CN(C2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)C

InChI

InChI=1S/C17H15ClF3N3O5S/c1-10-3-5-12(24(26)27)8-14(10)22-16(25)9-23(30(2,28)29)15-7-11(17(19,20)21)4-6-13(15)18/h3-8H,9H2,1-2H3,(H,22,25)