N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-3-yl-ethyl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-3-yl-ethyl]-4-(trifluoromethyl)benzamide Openeye Name: N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-(3-thienyl)ethyl]-4-(trifluoromethyl)benzamide CAS Name: N-[(2R)-2-(1-pyrrolidin-1-iumyl)-2-(3-thiophenyl)ethyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-3-ylethyl]-4-(trifluoromethyl)benzamide Traditional Name: N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-(3-thienyl)ethyl]-4-(trifluoromethyl)benzamide Formula: C18H20F3N2OS+ MolecularWeight: 369.42441

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)C2=CC=C(C=C2)C(F)(F)F)C3=CSC=C3

InChI

InChI=1S/C18H19F3N2OS/c19-18(20,21)15-5-3-13(4-6-15)17(24)22-11-16(14-7-10-25-12-14)23-8-1-2-9-23/h3-7,10,12,16H,1-2,8-9,11H2,(H,22,24)/p+1/t16-/m0/s1