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4-methyl-N-[3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propyl]benzenesulfonamide
4-methyl-N-[3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propyl]benzenesulfonamide
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC=C(C=C1)S(=O)(=O)NCCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]
Isomeric SMILES
CC1=CC=C(C=C1)S(=O)(=O)NCCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]
InChI
InChI=1S/C17H18F3N3O4S/c1-12-3-6-14(7-4-12)28(26,27)22-10-2-9-21-15-8-5-13(17(18,19)20)11-16(15)23(24)25/h3-8,11,21-22H,2,9-10H2,1H3
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