N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-3-(phenylsulfonylamino)benzamide

Systemtic Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-3-(phenylsulfonylamino)benzamide Openeye Name: 3-(benzenesulfonamido)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)benzamide CAS Name: 3-(benzenesulfonamido)-N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 3-(benzenesulfonamido)-N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)benzamide Traditional Name: 3-(benzenesulfonamido)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)benzamide Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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