1-[3-[[4-(dimethylsulfamoyl)phenyl]amino]-3-oxidanylidene-propyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[3-[[4-(dimethylsulfamoyl)phenyl]amino]-3-oxidanylidene-propyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[3-[4-(dimethylsulfamoyl)anilino]-3-oxo-propyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[3-[4-(dimethylsulfamoyl)anilino]-3-oxopropyl]-N-(2-hydroxyphenyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[3-[4-(dimethylsulfamoyl)anilino]-3-oxopropyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[3-[4-(dimethylsulfamoyl)anilino]-3-keto-propyl]-N-(2-hydroxyphenyl)piperidin-1-ium-4-carboxamide Formula: C23H31N4O5S+ MolecularWeight: 475.58104

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)CC[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3O

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)CC[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3O

InChI

InChI=1S/C23H30N4O5S/c1-26(2)33(31,32)19-9-7-18(8-10-19)24-22(29)13-16-27-14-11-17(12-15-27)23(30)25-20-5-3-4-6-21(20)28/h3-10,17,28H,11-16H2,1-2H3,(H,24,29)(H,25,30)/p+1