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4-[2-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]ethoxy]benzoic acid
4-[2-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]ethoxy]benzoic acid
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC(=CC=C1C(=O)O)OCCOC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]
Isomeric SMILES
C1=CC(=CC=C1C(=O)O)OCCOC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]
InChI
InChI=1S/C16H12F3NO8S/c17-16(18,19)29(25,26)12-5-6-14(13(9-12)20(23)24)28-8-7-27-11-3-1-10(2-4-11)15(21)22/h1-6,9H,7-8H2,(H,21,22)
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