N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-3-[(3-methylphenyl)sulfamoyl]benzamide

Systemtic Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-3-[(3-methylphenyl)sulfamoyl]benzamide Openeye Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-3-(m-tolylsulfamoyl)benzamide CAS Name: N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-3-[(3-methylphenyl)sulfamoyl]benzamide IUPAC Name: N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)-3-[(3-methylphenyl)sulfamoyl]benzamide Traditional Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-3-(m-tolylsulfamoyl)benzamide Formula: C22H30N3O4S+ MolecularWeight: 432.5563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NCC(C)(C)[NH+]3CCOCC3

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NCC(C)(C)[NH+]3CCOCC3

InChI

InChI=1S/C22H29N3O4S/c1-17-6-4-8-19(14-17)24-30(27,28)20-9-5-7-18(15-20)21(26)23-16-22(2,3)25-10-12-29-13-11-25/h4-9,14-15,24H,10-13,16H2,1-3H3,(H,23,26)/p+1