6-[(4-bromophenyl)-methyl-sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: 6-[(4-bromophenyl)-methyl-sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 6-[(4-bromophenyl)-methyl-sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: 6-[(4-bromophenyl)-methylsulfamoyl]-N-[3-(4-morpholin-4-iumyl)propyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 6-[(4-bromophenyl)-methylsulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 6-[(4-bromophenyl)-methyl-sulfamoyl]-4-keto-N-(3-morpholin-4-ium-4-ylpropyl)-1H-quinoline-3-carboxamide Formula: C24H28BrN4O5S+ MolecularWeight: 564.47192

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)Br)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCCC[NH+]4CCOCC4

Isomeric SMILES

CN(C1=CC=C(C=C1)Br)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C24H27BrN4O5S/c1-28(18-5-3-17(25)4-6-18)35(32,33)19-7-8-22-20(15-19)23(30)21(16-27-22)24(31)26-9-2-10-29-11-13-34-14-12-29/h3-8,15-16H,2,9-14H2,1H3,(H,26,31)(H,27,30)/p+1