2-(azocan-1-ium-1-yl)-N-[2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(azocan-1-ium-1-yl)-N-[2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(azocan-1-ium-1-yl)-N-[2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-(1-azocan-1-iumyl)-N-[2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(azocan-1-ium-1-yl)-N-[2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-(azocan-1-ium-1-yl)-N-[2-(trifluoromethyl)phenyl]acetamide Formula: C16H22F3N2O+ MolecularWeight: 315.35389

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CCC1)CC(=O)NC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

C1CCC[NH+](CCC1)CC(=O)NC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C16H21F3N2O/c17-16(18,19)13-8-4-5-9-14(13)20-15(22)12-21-10-6-2-1-3-7-11-21/h4-5,8-9H,1-3,6-7,10-12H2,(H,20,22)/p+1