2-[4-[2-(4-methylphenyl)ethyl]piperidin-1-ium-1-yl]-N-(2-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-[4-[2-(4-methylphenyl)ethyl]piperidin-1-ium-1-yl]-N-(2-methylsulfonylphenyl)ethanamide Openeye Name: N-(2-methylsulfonylphenyl)-2-[4-[2-(p-tolyl)ethyl]piperidin-1-ium-1-yl]acetamide CAS Name: 2-[4-[2-(4-methylphenyl)ethyl]-1-piperidin-1-iumyl]-N-(2-methylsulfonylphenyl)acetamide IUPAC Name: 2-[4-[2-(4-methylphenyl)ethyl]piperidin-1-ium-1-yl]-N-(2-methylsulfonylphenyl)acetamide Traditional Name: N-(2-mesylphenyl)-2-[4-[2-(p-tolyl)ethyl]piperidin-1-ium-1-yl]acetamide Formula: C23H31N2O3S+ MolecularWeight: 415.56884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CCC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C23H30N2O3S/c1-18-7-9-19(10-8-18)11-12-20-13-15-25(16-14-20)17-23(26)24-21-5-3-4-6-22(21)29(2,27)28/h3-10,20H,11-17H2,1-2H3,(H,24,26)/p+1