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4-[2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]ethyl]benzenesulfonamide
4-[2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]ethyl]benzenesulfonamide
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC(=CC=C1CCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])S(=O)(=O)N
Isomeric SMILES
C1=CC(=CC=C1CCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])S(=O)(=O)N
InChI
InChI=1S/C15H14F3N3O4S/c16-15(17,18)11-3-6-13(14(9-11)21(22)23)20-8-7-10-1-4-12(5-2-10)26(19,24)25/h1-6,9,20H,7-8H2,(H2,19,24,25)
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- methyl 4-[(4-dimethylaminophenyl)methylidene]-1-(2-methoxyethyl)-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate
