N-[4-[[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]sulfamoyl]phenyl]ethanamide

Systemtic Name: N-[4-[[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]sulfamoyl]phenyl]ethanamide Openeye Name: N-[4-[[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]sulfamoyl]phenyl]acetamide CAS Name: N-[4-[[(1R)-1-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]sulfamoyl]phenyl]acetamide IUPAC Name: N-[4-[[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]sulfamoyl]phenyl]acetamide Traditional Name: N-[4-[[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]sulfamoyl]phenyl]acetamide Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[NH+]2CCOCC2)NS(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[NH+]2CCOCC2)NS(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C21H27N3O4S/c1-16-3-5-18(6-4-16)21(15-24-11-13-28-14-12-24)23-29(26,27)20-9-7-19(8-10-20)22-17(2)25/h3-10,21,23H,11-15H2,1-2H3,(H,22,25)/p+1/t21-/m0/s1