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2-[[5-[2-nitro-4-(trifluoromethyl)phenyl]furan-2-yl]methylidene]indene-1,3-dione
2-[[5-[2-nitro-4-(trifluoromethyl)phenyl]furan-2-yl]methylidene]indene-1,3-dione
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC=C2C(=C1)C(=O)C(=CC3=CC=C(O3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-])C2=O
Isomeric SMILES
C1=CC=C2C(=C1)C(=O)C(=CC3=CC=C(O3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-])C2=O
InChI
InChI=1S/C21H10F3NO5/c22-21(23,24)11-5-7-15(17(9-11)25(28)29)18-8-6-12(30-18)10-16-19(26)13-3-1-2-4-14(13)20(16)27/h1-10H
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- 4-(2-hydroxyethylsulfanyl)-3-nitro-benzenecarbonitrile
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