1-[[5-(dimethylsulfamoyl)-2-oxidanylidene-pyridin-1-yl]methyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[[5-(dimethylsulfamoyl)-2-oxidanylidene-pyridin-1-yl]methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[[5-(dimethylsulfamoyl)-2-oxo-1-pyridyl]methyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]methyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[[5-(dimethylsulfamoyl)-2-oxopyridin-1-yl]methyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[[5-(dimethylsulfamoyl)-2-keto-1-pyridyl]methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C20H27N4O4S+ MolecularWeight: 419.51778

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CN(C(=O)C=C1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CN(C(=O)C=C1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H26N4O4S/c1-22(2)29(27,28)18-8-9-19(25)24(14-18)15-23-12-10-16(11-13-23)20(26)21-17-6-4-3-5-7-17/h3-9,14,16H,10-13,15H2,1-2H3,(H,21,26)/p+1