2-piperidin-1-ium-1-yl-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-piperidin-1-ium-1-yl-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-piperidin-1-ium-1-yl-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]acetamide CAS Name: 2-(1-piperidin-1-iumyl)-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-piperidin-1-ium-1-yl-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-piperidin-1-ium-1-yl-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]acetamide Formula: C16H19F3N5O+ MolecularWeight: 354.35017

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3C=NC=N3

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3C=NC=N3

InChI

InChI=1S/C16H18F3N5O/c17-16(18,19)12-4-5-14(24-11-20-10-21-24)13(8-12)22-15(25)9-23-6-2-1-3-7-23/h4-5,8,10-11H,1-3,6-7,9H2,(H,22,25)/p+1