2-(2-dimethylaminoethyl)-4-phenyl-2-[3-(trifluoromethyl)phenyl]butanenitrile hydrochloride

Systemtic Name: 2-(2-dimethylaminoethyl)-4-phenyl-2-[3-(trifluoromethyl)phenyl]butanenitrile hydrochloride Openeye Name: 2-(2-dimethylaminoethyl)-4-phenyl-2-[3-(trifluoromethyl)phenyl]butanenitrile hydrochloride CAS Name: 2-(2-dimethylaminoethyl)-4-phenyl-2-[3-(trifluoromethyl)phenyl]butanenitrile hydrochloride IUPAC Name: 2-(2-dimethylaminoethyl)-4-phenyl-2-[3-(trifluoromethyl)phenyl]butanenitrile hydrochloride Traditional Name: 2-(2-dimethylaminoethyl)-4-phenyl-2-[3-(trifluoromethyl)phenyl]butyronitrile hydrochloride Formula: C21H24ClF3N2 MolecularWeight: 396.87687

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC(CCC1=CC=CC=C1)(C#N)C2=CC(=CC=C2)C(F)(F)F.Cl

Isomeric SMILES

CN(C)CCC(CCC1=CC=CC=C1)(C#N)C2=CC(=CC=C2)C(F)(F)F.Cl

InChI

InChI=1S/C21H23F3N2.ClH/c1-26(2)14-13-20(16-25,12-11-17-7-4-3-5-8-17)18-9-6-10-19(15-18)21(22,23)24;/h3-10,15H,11-14H2,1-2H3;1H