2-(phenylmethylsulfanyl)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 2-(phenylmethylsulfanyl)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Openeye Name: 2-benzylsulfanyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide CAS Name: 2-(phenylmethylthio)-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)benzamide IUPAC Name: 2-benzylsulfanyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Traditional Name: 2-(benzylthio)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Formula: C23H31N2OS+ MolecularWeight: 383.57004

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=CC=CC=C2SCC3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=CC=CC=C2SCC3=CC=CC=C3)C

InChI

InChI=1S/C23H30N2OS/c1-22(2)14-18(15-23(3,4)25-22)24-21(26)19-12-8-9-13-20(19)27-16-17-10-6-5-7-11-17/h5-13,18,25H,14-16H2,1-4H3,(H,24,26)/p+1