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2-methyl-1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one
2-methyl-1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one
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Descriptors Computed from Structure
Canonical SMILES:
CC(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]
Isomeric SMILES
CC(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]
InChI
InChI=1S/C15H18F3N3O3/c1-10(2)14(22)20-7-5-19(6-8-20)12-4-3-11(15(16,17)18)9-13(12)21(23)24/h3-4,9-10H,5-8H2,1-2H3
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