2-(4-imidazol-1-ylpiperidin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(4-imidazol-1-ylpiperidin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(4-imidazol-1-ylpiperidin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[4-(1-imidazolyl)-1-piperidin-1-iumyl]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(4-imidazol-1-ylpiperidin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-(4-imidazol-1-ylpiperidin-1-ium-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C17H20F3N4O+ MolecularWeight: 353.36211

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C=CN=C2)CC(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1C[NH+](CCC1N2C=CN=C2)CC(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C17H19F3N4O/c18-17(19,20)13-2-1-3-14(10-13)22-16(25)11-23-7-4-15(5-8-23)24-9-6-21-12-24/h1-3,6,9-10,12,15H,4-5,7-8,11H2,(H,22,25)/p+1