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

Systemtic Name: 1-[2-[[5-(diethylsulfamoyl)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[5-(diethylsulfamoyl)-2-methyl-anilino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[5-(diethylsulfamoyl)-2-methylanilino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[5-(diethylsulfamoyl)-2-methylanilino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-[5-(diethylsulfamoyl)-2-methyl-anilino]-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C19H31N4O4S+ MolecularWeight: 411.53884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N4O4S/c1-4-23(5-2)28(26,27)16-7-6-14(3)17(12-16)21-18(24)13-22-10-8-15(9-11-22)19(20)25/h6-7,12,15H,4-5,8-11,13H2,1-3H3,(H2,20,25)(H,21,24)/p+1