2-[(2R)-2-(methylsulfonylaminomethyl)piperidin-1-ium-1-yl]-N-(4-phenylphenyl)ethanamide

Systemtic Name: 2-[(2R)-2-(methylsulfonylaminomethyl)piperidin-1-ium-1-yl]-N-(4-phenylphenyl)ethanamide Openeye Name: 2-[(2R)-2-(methanesulfonamidomethyl)piperidin-1-ium-1-yl]-N-(4-phenylphenyl)acetamide CAS Name: 2-[(2R)-2-(methanesulfonamidomethyl)-1-piperidin-1-iumyl]-N-(4-phenylphenyl)acetamide IUPAC Name: 2-[(2R)-2-(methanesulfonamidomethyl)piperidin-1-ium-1-yl]-N-(4-phenylphenyl)acetamide Traditional Name: 2-[(2R)-2-(methanesulfonamidomethyl)piperidin-1-ium-1-yl]-N-(4-phenylphenyl)acetamide Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC1CCCC[NH+]1CC(=O)NC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)NC[C@H]1CCCC[NH+]1CC(=O)NC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3S/c1-28(26,27)22-15-20-9-5-6-14-24(20)16-21(25)23-19-12-10-18(11-13-19)17-7-3-2-4-8-17/h2-4,7-8,10-13,20,22H,5-6,9,14-16H2,1H3,(H,23,25)/p+1/t20-/m1/s1