N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(trifluoromethyl)benzamide

Systemtic Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(trifluoromethyl)benzamide Openeye Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(trifluoromethyl)benzamide CAS Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-2-(trifluoromethyl)benzamide IUPAC Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-ylethyl]-2-(trifluoromethyl)benzamide Traditional Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(trifluoromethyl)benzamide Formula: C22H27F3N3O+ MolecularWeight: 406.46449

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=CC=CC=C2C(F)(F)F)[NH+]3CCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H](CNC(=O)C2=CC=CC=C2C(F)(F)F)[NH+]3CCCC3

InChI

InChI=1S/C22H26F3N3O/c1-27(2)17-11-9-16(10-12-17)20(28-13-5-6-14-28)15-26-21(29)18-7-3-4-8-19(18)22(23,24)25/h3-4,7-12,20H,5-6,13-15H2,1-2H3,(H,26,29)/p+1/t20-/m0/s1