1-[2-[[2-(dimethylamino)-5-(dimethylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[[2-(dimethylamino)-5-(dimethylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[2-(dimethylamino)-5-(dimethylsulfamoyl)anilino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[2-(dimethylamino)-5-(dimethylsulfamoyl)anilino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[2-(dimethylamino)-5-(dimethylsulfamoyl)anilino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-[2-(dimethylamino)-5-(dimethylsulfamoyl)anilino]-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C18H30N5O4S+ MolecularWeight: 412.5269

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C[NH+]2CCC(CC2)C(=O)N

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C[NH+]2CCC(CC2)C(=O)N

InChI

InChI=1S/C18H29N5O4S/c1-21(2)16-6-5-14(28(26,27)22(3)4)11-15(16)20-17(24)12-23-9-7-13(8-10-23)18(19)25/h5-6,11,13H,7-10,12H2,1-4H3,(H2,19,25)(H,20,24)/p+1