N-phenyl-2-[4-[[4-(trifluoromethylsulfonyl)phenyl]amino]piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-phenyl-2-[4-[[4-(trifluoromethylsulfonyl)phenyl]amino]piperidin-1-ium-1-yl]ethanamide Openeye Name: N-phenyl-2-[4-[4-(trifluoromethylsulfonyl)anilino]piperidin-1-ium-1-yl]acetamide CAS Name: N-phenyl-2-[4-[4-(trifluoromethylsulfonyl)anilino]-1-piperidin-1-iumyl]acetamide IUPAC Name: N-phenyl-2-[4-[4-(trifluoromethylsulfonyl)anilino]piperidin-1-ium-1-yl]acetamide Traditional Name: N-phenyl-2-[4-(4-triflylanilino)piperidin-1-ium-1-yl]acetamide Formula: C20H23F3N3O3S+ MolecularWeight: 442.47513

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC2=CC=C(C=C2)S(=O)(=O)C(F)(F)F)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NC2=CC=C(C=C2)S(=O)(=O)C(F)(F)F)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H22F3N3O3S/c21-20(22,23)30(28,29)18-8-6-16(7-9-18)24-17-10-12-26(13-11-17)14-19(27)25-15-4-2-1-3-5-15/h1-9,17,24H,10-14H2,(H,25,27)/p+1