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

Systemtic Name: 3-methyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]benzamide Openeye Name: 3-methyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]benzamide CAS Name: 3-methyl-N-[4-[3-(4-morpholin-4-iumyl)propylsulfamoyl]phenyl]benzamide IUPAC Name: 3-methyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]benzamide Traditional Name: 3-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=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

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

InChI

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