2-[(4-methylphenyl)sulfonylamino]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-(p-tolylsulfonylamino)benzamide CAS Name: 2-[(4-methylphenyl)sulfonylamino]-N-[3-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-(tosylamino)benzamide Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C21H27N3O4S/c1-17-7-9-18(10-8-17)29(26,27)23-20-6-3-2-5-19(20)21(25)22-11-4-12-24-13-15-28-16-14-24/h2-3,5-10,23H,4,11-16H2,1H3,(H,22,25)/p+1