ethyl 1-[[4-(diethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[[4-(diethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[[4-(diethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[4-(diethylsulfamoyl)-3,5-dimethyl-1-pyrazolyl]methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[4-(diethylsulfamoyl)-3,5-dimethylpyrazol-1-yl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[[4-(diethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C18H33N4O4S+ MolecularWeight: 401.54402

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(N(N=C1C)C[NH+]2CCC(CC2)C(=O)OCC)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(N(N=C1C)C[NH+]2CCC(CC2)C(=O)OCC)C

InChI

InChI=1S/C18H32N4O4S/c1-6-21(7-2)27(24,25)17-14(4)19-22(15(17)5)13-20-11-9-16(10-12-20)18(23)26-8-3/h16H,6-13H2,1-5H3/p+1