2-(2-dimethylaminoethyl)-3-phenyl-5-(trifluoromethyl)isoindole-1-carboxylic acid

Systemtic Name: 2-(2-dimethylaminoethyl)-3-phenyl-5-(trifluoromethyl)isoindole-1-carboxylic acid Openeye Name: 2-(2-dimethylaminoethyl)-3-phenyl-5-(trifluoromethyl)isoindole-1-carboxylic acid CAS Name: 2-(2-dimethylaminoethyl)-3-phenyl-5-(trifluoromethyl)-1-isoindolecarboxylic acid IUPAC Name: 2-(2-dimethylaminoethyl)-3-phenyl-5-(trifluoromethyl)isoindole-1-carboxylic acid Traditional Name: 2-(2-dimethylaminoethyl)-3-phenyl-5-(trifluoromethyl)isoindole-1-carboxylic acid Formula: C20H19F3N2O2 MolecularWeight: 376.37227

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(=C2C=C(C=CC2=C1C(=O)O)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CN(C)CCN1C(=C2C=C(C=CC2=C1C(=O)O)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C20H19F3N2O2/c1-24(2)10-11-25-17(13-6-4-3-5-7-13)16-12-14(20(21,22)23)8-9-15(16)18(25)19(26)27/h3-9,12H,10-11H2,1-2H3,(H,26,27)