N-[5-(diethylsulfamoyl)-2-oxidanyl-phenyl]-2-(2,4-dimethylquinolin-1-ium-3-yl)ethanamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-oxidanyl-phenyl]-2-(2,4-dimethylquinolin-1-ium-3-yl)ethanamide Openeye Name: N-[5-(diethylsulfamoyl)-2-hydroxy-phenyl]-2-(2,4-dimethylquinolin-1-ium-3-yl)acetamide CAS Name: N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2,4-dimethyl-3-quinolin-1-iumyl)acetamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2,4-dimethylquinolin-1-ium-3-yl)acetamide Traditional Name: N-[5-(diethylsulfamoyl)-2-hydroxy-phenyl]-2-(2,4-dimethylquinolin-1-ium-3-yl)acetamide Formula: C23H28N3O4S+ MolecularWeight: 442.55112

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)CC2=C(C3=CC=CC=C3[NH+]=C2C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)CC2=C(C3=CC=CC=C3[NH+]=C2C)C

InChI

InChI=1S/C23H27N3O4S/c1-5-26(6-2)31(29,30)17-11-12-22(27)21(13-17)25-23(28)14-19-15(3)18-9-7-8-10-20(18)24-16(19)4/h7-13,27H,5-6,14H2,1-4H3,(H,25,28)/p+1