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6-butan-2-yl-2-[3-(trifluoromethyl)phenyl]quinoline-4-carboxylic acid
6-butan-2-yl-2-[3-(trifluoromethyl)phenyl]quinoline-4-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CCC(C)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC(=CC=C3)C(F)(F)F
Isomeric SMILES
CCC(C)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC(=CC=C3)C(F)(F)F
InChI
InChI=1S/C21H18F3NO2/c1-3-12(2)13-7-8-18-16(10-13)17(20(26)27)11-19(25-18)14-5-4-6-15(9-14)21(22,23)24/h4-12H,3H2,1-2H3,(H,26,27)
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