N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-3-(trifluoromethyl)benzamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-3-(trifluoromethyl)benzamide Formula: C19H22F3N2O2+ MolecularWeight: 367.38539

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(CNC(=O)C2=CC(=CC=C2)C(F)(F)F)C3=CC=CO3

Isomeric SMILES

C1CC[NH+](CC1)[C@@H](CNC(=O)C2=CC(=CC=C2)C(F)(F)F)C3=CC=CO3

InChI

InChI=1S/C19H21F3N2O2/c20-19(21,22)15-7-4-6-14(12-15)18(25)23-13-16(17-8-5-11-26-17)24-9-2-1-3-10-24/h4-8,11-12,16H,1-3,9-10,13H2,(H,23,25)/p+1/t16-/m0/s1