N-[2-[[4-nitro-2-(trifluoromethyl)phenyl]amino]ethyl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[2-[[4-nitro-2-(trifluoromethyl)phenyl]amino]ethyl]-1-phenyl-methanesulfonamide Openeye Name: N-[2-[4-nitro-2-(trifluoromethyl)anilino]ethyl]-1-phenyl-methanesulfonamide CAS Name: N-[2-[4-nitro-2-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide IUPAC Name: N-[2-[4-nitro-2-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide Traditional Name: N-[2-[4-nitro-2-(trifluoromethyl)anilino]ethyl]-1-phenyl-methanesulfonamide Formula: C16H16F3N3O4S MolecularWeight: 403.37615

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)NCCNC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)NCCNC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C16H16F3N3O4S/c17-16(18,19)14-10-13(22(23)24)6-7-15(14)20-8-9-21-27(25,26)11-12-4-2-1-3-5-12/h1-7,10,20-21H,8-9,11H2