N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(trifluoromethyl)benzamide Openeye Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(trifluoromethyl)benzamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-4-(trifluoromethyl)benzamide Traditional Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(trifluoromethyl)benzamide Formula: C18H20F3N2O2+ MolecularWeight: 353.35881

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=CC=C(C=C2)C(F)(F)F)C3=CC=CO3

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)C2=CC=C(C=C2)C(F)(F)F)C3=CC=CO3

InChI

InChI=1S/C18H19F3N2O2/c19-18(20,21)14-7-5-13(6-8-14)17(24)22-12-15(16-4-3-11-25-16)23-9-1-2-10-23/h3-8,11,15H,1-2,9-10,12H2,(H,22,24)/p+1/t15-/m0/s1