4-[[(4-methylphenyl)sulfonylamino]methyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)NCC[NH+]3CCOCC3

InChI

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