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2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-propylsulfonyl-propan-2-ol
2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-propylsulfonyl-propan-2-ol
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Descriptors Computed from Structure
Canonical SMILES:
CCCS(=O)(=O)CC(C)(C1=CC2=CC(=C(C=C2N1)C(F)(F)F)[N+](=O)[O-])O
Isomeric SMILES
CCCS(=O)(=O)CC(C)(C1=CC2=CC(=C(C=C2N1)C(F)(F)F)[N+](=O)[O-])O
InChI
InChI=1S/C15H17F3N2O5S/c1-3-4-26(24,25)8-14(2,21)13-6-9-5-12(20(22)23)10(15(16,17)18)7-11(9)19-13/h5-7,19,21H,3-4,8H2,1-2H3
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