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2-(2-diethylaminoethyl)-3-[3-(trifluoromethyl)phenyl]isoindole-1-carboxylic acid
2-(2-diethylaminoethyl)-3-[3-(trifluoromethyl)phenyl]isoindole-1-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CCN(CC)CCN1C(=C2C=CC=CC2=C1C(=O)O)C3=CC(=CC=C3)C(F)(F)F
Isomeric SMILES
CCN(CC)CCN1C(=C2C=CC=CC2=C1C(=O)O)C3=CC(=CC=C3)C(F)(F)F
InChI
InChI=1S/C22H23F3N2O2/c1-3-26(4-2)12-13-27-19(15-8-7-9-16(14-15)22(23,24)25)17-10-5-6-11-18(17)20(27)21(28)29/h5-11,14H,3-4,12-13H2,1-2H3,(H,28,29)
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