2-(azocan-1-ium-1-yl)-N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]ethanamide

Systemtic Name: 2-(azocan-1-ium-1-yl)-N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]ethanamide Openeye Name: 2-(azocan-1-ium-1-yl)-N-[2-(difluoromethylsulfanyl)phenyl]acetamide CAS Name: 2-(1-azocan-1-iumyl)-N-[2-(difluoromethylthio)phenyl]acetamide IUPAC Name: 2-(azocan-1-ium-1-yl)-N-[2-(difluoromethylsulfanyl)phenyl]acetamide Traditional Name: 2-(azocan-1-ium-1-yl)-N-[2-(difluoromethylthio)phenyl]acetamide Formula: C16H23F2N2OS+ MolecularWeight: 329.428426

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CCC1)CC(=O)NC2=CC=CC=C2SC(F)F

Isomeric SMILES

C1CCC[NH+](CCC1)CC(=O)NC2=CC=CC=C2SC(F)F

InChI

InChI=1S/C16H22F2N2OS/c17-16(18)22-14-9-5-4-8-13(14)19-15(21)12-20-10-6-2-1-3-7-11-20/h4-5,8-9,16H,1-3,6-7,10-12H2,(H,19,21)/p+1