2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide

Systemtic Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide Openeye Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide CAS Name: 2-[(3S)-3-methyl-1-piperidin-1-iumyl]-N-[4-(trifluoromethoxy)phenyl]acetamide IUPAC Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide Traditional Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide Formula: C15H20F3N2O2+ MolecularWeight: 317.32671

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NC2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C15H19F3N2O2/c1-11-3-2-8-20(9-11)10-14(21)19-12-4-6-13(7-5-12)22-15(16,17)18/h4-7,11H,2-3,8-10H2,1H3,(H,19,21)/p+1/t11-/m0/s1