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

Systemtic Name: 6-[(3,4-dimethylphenyl)-methyl-sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 6-[(3,4-dimethylphenyl)-methyl-sulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: 6-[(3,4-dimethylphenyl)-methylsulfamoyl]-N-[2-(4-morpholin-4-iumyl)ethyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 6-[(3,4-dimethylphenyl)-methylsulfamoyl]-N-(2-morpholin-4-ium-4-ylethyl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 6-[(3,4-dimethylphenyl)-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:

CC1=C(C=C(C=C1)N(C)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCC[NH+]4CCOCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(C)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)NCC[NH+]4CCOCC4)C

InChI

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