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4-ethyl-8-methyl-7-[4-nitro-2-(trifluoromethyl)phenoxy]chromen-2-one
4-ethyl-8-methyl-7-[4-nitro-2-(trifluoromethyl)phenoxy]chromen-2-one
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Descriptors Computed from Structure
Canonical SMILES:
CCC1=CC(=O)OC2=C1C=CC(=C2C)OC3=C(C=C(C=C3)[N+](=O)[O-])C(F)(F)F
Isomeric SMILES
CCC1=CC(=O)OC2=C1C=CC(=C2C)OC3=C(C=C(C=C3)[N+](=O)[O-])C(F)(F)F
InChI
InChI=1S/C19H14F3NO5/c1-3-11-8-17(24)28-18-10(2)15(7-5-13(11)18)27-16-6-4-12(23(25)26)9-14(16)19(20,21)22/h4-9H,3H2,1-2H3
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- 3-(3-hydroxyphenyl)propanoic acid
- 3-oxidanylidenehexanedioic acid
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- 2-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-5,6-dimethyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one
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- 5-[[5-[2-ethyl-1,3-bis(oxidanylidene)isoindol-5-yl]furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione
