3-(dimethylsulfamoyl)-4,5-dimethyl-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3-(dimethylsulfamoyl)-4,5-dimethyl-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-(dimethylsulfamoyl)-4,5-dimethyl-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-(dimethylsulfamoyl)-4,5-dimethyl-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-(dimethylsulfamoyl)-4,5-dimethyl-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-(dimethylsulfamoyl)-4,5-dimethyl-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C24H34N3O3S+ MolecularWeight: 444.61006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCCCC3)S(=O)(=O)N(C)C)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCCCC3)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C24H33N3O3S/c1-18-14-22(15-23(19(18)2)31(29,30)26(3)4)24(28)25-16-20-8-10-21(11-9-20)17-27-12-6-5-7-13-27/h8-11,14-15H,5-7,12-13,16-17H2,1-4H3,(H,25,28)/p+1