4-[(4-methylphenyl)sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide

Systemtic Name: 4-[(4-methylphenyl)sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-(p-tolylsulfamoyl)benzamide CAS Name: 4-[(4-methylphenyl)sulfamoyl]-N-[3-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 4-[(4-methylphenyl)sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-(p-tolylsulfamoyl)benzamide Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O4S/c1-17-3-7-19(8-4-17)23-29(26,27)20-9-5-18(6-10-20)21(25)22-11-2-12-24-13-15-28-16-14-24/h3-10,23H,2,11-16H2,1H3,(H,22,25)/p+1