4-methyl-3-[(2-methylphenyl)sulfamoyl]-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide

Systemtic Name: 4-methyl-3-[(2-methylphenyl)sulfamoyl]-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Openeye Name: 4-methyl-3-(o-tolylsulfamoyl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide CAS Name: 4-methyl-3-[(2-methylphenyl)sulfamoyl]-N-[3-(1-pyrrolidin-1-iumyl)propyl]benzamide IUPAC Name: 4-methyl-3-[(2-methylphenyl)sulfamoyl]-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Traditional Name: 4-methyl-3-(o-tolylsulfamoyl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Formula: C22H30N3O3S+ MolecularWeight: 416.5569

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCC[NH+]2CCCC2)S(=O)(=O)NC3=CC=CC=C3C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCC[NH+]2CCCC2)S(=O)(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C22H29N3O3S/c1-17-8-3-4-9-20(17)24-29(27,28)21-16-19(11-10-18(21)2)22(26)23-12-7-15-25-13-5-6-14-25/h3-4,8-11,16,24H,5-7,12-15H2,1-2H3,(H,23,26)/p+1