6-(diethylsulfamoyl)-N-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: 6-(diethylsulfamoyl)-N-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 6-(diethylsulfamoyl)-N-(2-morpholin-4-ium-4-ylethyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: 6-(diethylsulfamoyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 6-(diethylsulfamoyl)-N-(2-morpholin-4-ium-4-ylethyl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 6-(diethylsulfamoyl)-4-keto-N-(2-morpholin-4-ium-4-ylethyl)-1H-quinoline-3-carboxamide Formula: C20H29N4O5S+ MolecularWeight: 437.53306

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)NC=C(C2=O)C(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)NC=C(C2=O)C(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C20H28N4O5S/c1-3-24(4-2)30(27,28)15-5-6-18-16(13-15)19(25)17(14-22-18)20(26)21-7-8-23-9-11-29-12-10-23/h5-6,13-14H,3-4,7-12H2,1-2H3,(H,21,26)(H,22,25)/p+1