1-[2-[[[2-nitro-4-(trifluoromethyl)phenyl]amino]methyl]phenyl]-N-propan-2-yl-methanesulfonamide

Systemtic Name: 1-[2-[[[2-nitro-4-(trifluoromethyl)phenyl]amino]methyl]phenyl]-N-propan-2-yl-methanesulfonamide Openeye Name: N-isopropyl-1-[2-[[2-nitro-4-(trifluoromethyl)anilino]methyl]phenyl]methanesulfonamide CAS Name: 1-[2-[[2-nitro-4-(trifluoromethyl)anilino]methyl]phenyl]-N-propan-2-ylmethanesulfonamide IUPAC Name: 1-[2-[[2-nitro-4-(trifluoromethyl)anilino]methyl]phenyl]-N-propan-2-ylmethanesulfonamide Traditional Name: N-isopropyl-1-[2-[[2-nitro-4-(trifluoromethyl)anilino]methyl]phenyl]methanesulfonamide Formula: C18H20F3N3O4S MolecularWeight: 431.42931

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)CC1=CC=CC=C1CNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)CC1=CC=CC=C1CNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H20F3N3O4S/c1-12(2)23-29(27,28)11-14-6-4-3-5-13(14)10-22-16-8-7-15(18(19,20)21)9-17(16)24(25)26/h3-9,12,22-23H,10-11H2,1-2H3