N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(trifluoromethyl)benzamide CAS Name: N-[(2R)-2-(2-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(trifluoromethyl)benzamide Formula: C21H24F3N2O2+ MolecularWeight: 393.42267

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CNC(=O)C2=CC(=CC=C2)C(F)(F)F)[NH+]3CCCC3

Isomeric SMILES

COC1=CC=CC=C1[C@H](CNC(=O)C2=CC(=CC=C2)C(F)(F)F)[NH+]3CCCC3

InChI

InChI=1S/C21H23F3N2O2/c1-28-19-10-3-2-9-17(19)18(26-11-4-5-12-26)14-25-20(27)15-7-6-8-16(13-15)21(22,23)24/h2-3,6-10,13,18H,4-5,11-12,14H2,1H3,(H,25,27)/p+1/t18-/m0/s1