6-[(4-ethylphenyl)-methyl-sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: 6-[(4-ethylphenyl)-methyl-sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 6-[(4-ethylphenyl)-methyl-sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: 6-[(4-ethylphenyl)-methylsulfamoyl]-N-[2-(4-morpholin-4-iumyl)ethyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 6-[(4-ethylphenyl)-methylsulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 6-[(4-ethylphenyl)-methyl-sulfamoyl]-4-keto-N-(2-morpholin-4-ium-4-ylethyl)-1H-quinoline-3-carboxamide Formula: C25H31N4O5S+ MolecularWeight: 499.60244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

CCC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C25H30N4O5S/c1-3-18-4-6-19(7-5-18)28(2)35(32,33)20-8-9-23-21(16-20)24(30)22(17-27-23)25(31)26-10-11-29-12-14-34-15-13-29/h4-9,16-17H,3,10-15H2,1-2H3,(H,26,31)(H,27,30)/p+1