3-[[[2-nitro-4-(trifluoromethyl)phenyl]amino]methyl]-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 3-[[[2-nitro-4-(trifluoromethyl)phenyl]amino]methyl]-N-propan-2-yl-benzenesulfonamide Openeye Name: N-isopropyl-3-[[2-nitro-4-(trifluoromethyl)anilino]methyl]benzenesulfonamide CAS Name: 3-[[2-nitro-4-(trifluoromethyl)anilino]methyl]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 3-[[2-nitro-4-(trifluoromethyl)anilino]methyl]-N-propan-2-ylbenzenesulfonamide Traditional Name: N-isopropyl-3-[[2-nitro-4-(trifluoromethyl)anilino]methyl]benzenesulfonamide Formula: C17H18F3N3O4S MolecularWeight: 417.40273

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC=CC(=C1)CNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC=CC(=C1)CNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H18F3N3O4S/c1-11(2)22-28(26,27)14-5-3-4-12(8-14)10-21-15-7-6-13(17(18,19)20)9-16(15)23(24)25/h3-9,11,21-22H,10H2,1-2H3