1-[[4-(dimethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[[4-(dimethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[[4-(dimethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[[4-(dimethylsulfamoyl)-3,5-dimethyl-1-pyrazolyl]methyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[[4-(dimethylsulfamoyl)-3,5-dimethylpyrazol-1-yl]methyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[[4-(dimethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C20H30N5O3S+ MolecularWeight: 420.5489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3)C)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C(=NN1C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3)C)S(=O)(=O)N(C)C

InChI

InChI=1S/C20H29N5O3S/c1-15-19(29(27,28)23(3)4)16(2)25(22-15)14-24-12-10-17(11-13-24)20(26)21-18-8-6-5-7-9-18/h5-9,17H,10-14H2,1-4H3,(H,21,26)/p+1