3-[(3-methylphenyl)sulfamoyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide

Systemtic Name: 3-[(3-methylphenyl)sulfamoyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Openeye Name: 3-(m-tolylsulfamoyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide CAS Name: 3-[(3-methylphenyl)sulfamoyl]-N-[2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 3-[(3-methylphenyl)sulfamoyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Traditional Name: 3-(m-tolylsulfamoyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Formula: C20H26N3O3S+ MolecularWeight: 388.50374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NCC[NH+]3CCCC3

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NCC[NH+]3CCCC3

InChI

InChI=1S/C20H25N3O3S/c1-16-6-4-8-18(14-16)22-27(25,26)19-9-5-7-17(15-19)20(24)21-10-13-23-11-2-3-12-23/h4-9,14-15,22H,2-3,10-13H2,1H3,(H,21,24)/p+1