4-methyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]benzamide

Systemtic Name: 4-methyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]benzamide Openeye Name: 4-methyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]benzamide CAS Name: 4-methyl-N-[4-[3-(4-morpholin-4-iumyl)propylsulfamoyl]phenyl]benzamide IUPAC Name: 4-methyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]benzamide Traditional Name: 4-methyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]benzamide Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCCC[NH+]3CCOCC3

InChI

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