N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-4-(trifluoromethyloxy)benzamide

Systemtic Name: N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-4-(trifluoromethyloxy)benzamide Openeye Name: N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-4-(trifluoromethoxy)benzamide CAS Name: N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-4-(trifluoromethoxy)benzamide IUPAC Name: N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-4-(trifluoromethoxy)benzamide Traditional Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]-4-(trifluoromethoxy)benzamide Formula: C20H22F3N2O2+ MolecularWeight: 379.39609

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C20H21F3N2O2/c21-20(22,23)27-18-9-7-17(8-10-18)19(26)24-13-15-3-5-16(6-4-15)14-25-11-1-2-12-25/h3-10H,1-2,11-14H2,(H,24,26)/p+1