4-[(3,4-dimethylphenyl)sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide

Systemtic Name: 4-[(3,4-dimethylphenyl)sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Openeye Name: 4-[(3,4-dimethylphenyl)sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide CAS Name: 4-[(3,4-dimethylphenyl)sulfamoyl]-N-[2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: 4-[(3,4-dimethylphenyl)sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Traditional Name: 4-[(3,4-dimethylphenyl)sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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